Difference between revisions of "Template:Chembox/doc/full parameter list"
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| − | * [[:Category:Chembox templates|Chembox templates]] {{middot}}[[:Category:Chembox | + | * [[:Category:Chembox templates|Chembox templates]] {{middot}}[[:Category:Chembox tracking categories|Tracking categories]]<noinclude> |
[[Category:Chembox documentation| ]] | [[Category:Chembox documentation| ]] | ||
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Latest revision as of 12:12, 30 November 2016
This page lists the parameters available in {{Chembox}}. (Not all: after index #1, index numbers 2, 3, 4, 5 are omitted. So |CASNo=, |CASNo1= are listed here; existing |CASNo2= ... |CASNo5= are not).
Contents
Chembox
This parameter list:
{{Chembox
| Reference =
<!-- Names -->
| Name =
| pronounce =
| IUPACName =
| IUPACNames = <!-- -s for plural -->
| PIN =
| SystematicName =
| OtherNames =
<!-- Image parameters: see below -->
<!-- Sections -->
| Section1 =
| Section2 =
| Section3 =
| Section4 =
| Section5 =
| Section6 =
| Section7 =
| Section8 =
| Section9 =
<!-- Style settings -->
| style =
| width =
<!-- Bot parameter. Do not add, change or remove -->
| Verifiedfields =
| Watchedfields =
| verifiedrevid =
<!-- IMAGE row 1/7 -->
| ImageFile =
| ImageSize =
| ImageAlt =
| ImageCaption =
| ImageName =
<!-- IMAGE row 2/7 -->
| ImageFile1 =
| ImageSize1 =
| ImageAlt1 =
| ImageCaption1 =
| ImageName1 =
<!-- IMAGE (L1, R1) row 3/7 -->
| ImageFileL1 =
| ImageSizeL1 =
| ImageAltL1 =
| ImageCaptionL1 =
| ImageNameL1 =
| ImageFileR1 =
| ImageSizeR1 =
| ImageAltR1 =
| ImageCaptionR1 =
| ImageNameR1 =
| ImageCaptionLR1 =
<!-- IMAGE row 4/7 -->
| ImageFile2 =
| ImageSize2 =
| ImageAlt2 =
| ImageCaption2 =
| ImageName2 =
<!-- IMAGE (L2, R2) row 5/7 -->
| ImageFileL2 =
| ImageSizeL2 =
| ImageAltL2 =
| ImageCaptionL2 =
| ImageNameL2 =
| ImageFileR2 =
| ImageSizeR2 =
| ImageAltR2 =
| ImageCaptionR2 =
| ImageNameR2 =
| ImageCaptionLR2=
<!-- IMAGE row 6/7 -->
| ImageFile3 =
| ImageSize3 =
| ImageAlt3 =
| ImageCaption3 =
| ImageName3 =
<!-- IMAGE (L3, 3R) row 7/7 -->
| ImageFileL3 =
| ImageSizeL3 =
| ImageAltL3 =
| ImageCaptionL3 =
| ImageNameL3 =
| ImageFileR3 =
| ImageSizeR3 =
| ImageAltR3 =
| ImageCaptionR3 =
| ImageNameR3 =
| ImageCaptionLR3=
<!-- -->
| ImageCaptionAll =
<!-- non-default (data page) pagename (link in Supplement) -->
| data page pagename =
<!-- footer settings -->
| container_only =
| show_footer =
| show_ss_note =
| show_infobox_ref =
| general_note =
}}
|
Chembox Identifiers
This parameter list:
|Section1={{Chembox Identifiers
| Identifiers_ref =
<!-- indexlabeling-->
| index_label =
| index1_label =
| indexlist_caption =
| index_comment =
| index1_comment =
<!--CASNo, +ix 1–5-->
| CASNo =
| CASNo_Comment =
| CASNo1 =
| CASNo1_Comment =
| CASNoOther =
<!--ChEBI, +ix 1–5-->
| ChEBI =
| ChEBI_Comment =
| ChEBI1 =
| ChEBI1_Comment =
| ChEBIOther =
<!--ChEMBL, +ix 1–5-->
| ChEMBL =
| ChEMBL_Comment =
| ChEMBL1 =
| ChEMBL1_Comment =
| ChEMBLOther =
<!--ChemSpiderID, +ix 1–5-->
| ChemSpiderID =
| ChemSpiderID_Comment =
| ChemSpiderID1 =
| ChemSpiderID1_Comment =
| ChemSpiderIDOther =
<!--DrugBank, +ix 1–5-->
| DrugBank =
| DrugBank_Comment =
| DrugBank1 =
| DrugBank1_Comment =
| DrugBankOther =
<!--IUPHAR_ligand, +ix 1–5-->
| IUPHAR_ligand =
| IUPHAR_ligand_Comment =
| IUPHAR_ligand1 =
| IUPHAR_ligand1_Comment =
| IUPHAR_ligand_Other =
<!--KEGG, +ix 1–5-->
| KEGG =
| KEGG_Comment =
| KEGG1 =
| KEGG1_Comment =
| KEGGOther =
<!--PubChem, +ix 1–5-->
| PubChem =
| PubChem_Comment =
| PubChem1 =
| PubChem1_Comment =
| PubChemOther =
<!--SMILES, Jmol 1–5-->
| SMILES =
| SMILES_Comment =
| SMILES1 =
| SMILES1_Comment =
| SMILESOther =
| Jmol =
| Jmol1 =
<!--StdInChI-->
| StdInChI =
| StdInChI_Comment =
| StdInChIKey =
<!--InChI, InChIKey: index 1–5-->
| InChI =
| InChI_Comment =
| InChIKey =
| InChI1 =
| InChI1_Comment =
| InChIKey1 =
| InChIOther =
<!--UNII, +ix 1–5-->
| UNII =
| UNII_Comment =
| UNII1 =
| UNII1_Comment =
| UNIIOther =
<!-- DTXSID (CompTox), +ix 1–5-->
| DTXSID =
| DTXSID1 ... DTXSID5 =
| DTXSIDOther =
<!--3DMet, +ix 1–5-->
| 3DMet =
<!--EC_number, +ix 1–5-->
| EC_number =
| EC_number1 ... EC_number5 =
| EC_number_Comment =
| EINECS =
<!--RTECS, +ix 1–5-->
| RTECS =
| RTECS1 ... RTECS5 =
| RTECSOther =
<!--non-index parameters-->
| Abbreviations =
| Beilstein =
| Gmelin =
| MeSHName =
| UNNumber =
}}
|
Chembox Properties
This parameter list:
| Section2={{Chembox Properties
| Properties_ref =
| Formula =
| Formula_ref =
| Formula_Comment =
| C= | H= | N= <!--(etc)-->
| Formula_Charge =
| MolarMass =
| MolarMassRound =
| MolarMass_ref =
| MolarMass_notes =
| Appearance =
| Odor = | Odour =
| Density =
| MeltingPt =
| MeltingPtC =
| MeltingPtF =
| MeltingPtK =
| MeltingPt_ref =
| MeltingPt_notes =
| BoilingPt =
| BoilingPtC =
| BoilingPtF =
| BoilingPtK =
| BoilingPt_ref =
| BoilingPt_notes =
| CriticalTP =
| SublimationConditions =
| Solubility =
| SolubilityProduct =
| SolubilityProductAs =
| SolubleOther =
| Solvent =
| Solubility1 =
| Solvent1 =
| Solubility2 =
| Solvent2 =
| Solubility3 =
| Solvent3 =
| Solubility4 =
| Solvent4 =
| Solubility5 =
| Solvent5 =
| CMC =
| HLB =
| LogP =
| VaporPressure =
| HenryConstant =
| AtmosphericOHRateConstant =
| pKa =
| pKb =
| ConjugateAcid =
| ConjugateBase =
| IsoelectricPt =
| LambdaMax =
| Absorbance =
| BandGap =
| ElectronMobility =
| SpecRotation =
| MagSus =
| ThermalConductivity =
| RefractIndex =
| Viscosity =
| CriticalRelativeHumidity =
| Dipole =
| OrbitalHybridisation =
| SpecificSurfaceArea =
| PoreVolume =
| AveragePoreSize =
}}
|
Chembox Structure
| Section3 = {{Chembox Structure
| Structure_ref =
| CrystalStruct =
| SpaceGroup =
| PointGroup =
| LattConst_a =
| LattConst_b =
| LattConst_c =
| LattConst_alpha =
| LattConst_beta =
| LattConst_gamma =
| LattConst_ref =
| LattConst_Comment =
| UnitCellVolume =
| UnitCellFormulas =
| Coordination =
| MolShape =
| OrbitalHybridisation =
| Dipole =
}}
|
Chembox Thermochemistry
| Section4 = {{Chembox Thermochemistry
| Thermochemistry_ref =
| HeatCapacity =
| Entropy =
| DeltaHform =
| DeltaGfree =
| DeltaHcombust =
| DeltaHfus =
| DeltaHvap =
| DeltaHsublim =
| HHV =
| LHV =
}}
|
Note: Add units like
kJ·mol<sup>−1</sup>
J·mol<sup>−1</sup>·K<sup>−1</sup>
- Deprecated parameters
- DeltaHf → use DeltaHform
- DeltaGf → use DeltaGfree
- DeltaHc → use DeltaHcombust
Chembox Explosive
This parameter list:
| Section5 = {{Chembox Explosive
| Explosive_ref =
| ShockSens =
| FrictionSens =
| DetonationV =
| REFactor =
}}
|
- Complete list
Chembox Pharmacology
This parameter list:
| Section6 = {{Chembox Pharmacology
| Pharmacology_ref =
| ATCCode_prefix =
| ATCCode_suffix =
| ATC_Supplemental =
| ATCvet =
| Licence_EU =
| INN =
| INN_EMA =
| Licence_US =
| Legal_status =
| Legal_AU =
| Legal_AU_comment =
| Legal_CA =
| Legal_CA_comment =
| Legal_NZ =
| Legal_NZ_comment =
| Legal_UK =
| Legal_UK_comment =
| Legal_US =
| Legal_US_comment =
| Legal_EU =
| Legal_EU_comment =
| Legal_UN =
| Legal_UN_comment =
| Pregnancy_category =
| Pregnancy_AU =
| Pregnancy_AU_comment =
| Pregnancy_US =
| Pregnancy_US_comment =
| Dependence_liability =
| Addiction_liability =
| AdminRoutes =
| Bioavail =
| ProteinBound =
| Metabolism =
| Metabolites =
| OnsetOfAction =
| HalfLife =
| DurationOfAction =
| Excretion =
}}
|
- Complete list
Chembox Hazards
This parameter list:
| Section7 = {{Chembox Hazards
| Hazards_ref =
<!-- (data page) -->
| ExternalSDS =
| GHSPictograms =
| GHSSignalWord =
| HPhrases =
| PPhrases =
| MainHazards =
| IngestionHazard =
| InhalationHazard =
| EyeHazard =
| SkinHazard =
| NFPA-F =
| NFPA-H =
| NFPA-R =
| NFPA-S =
| NFPA_ref =
| FlashPt =
| FlashPtC =
| FlashPt_notes =
| FlashPt_ref =
| AutoignitionPt =
| AutoignitionPtC =
| AutoignitionPt_ref=
| AutoignitionPt_notes=
| ExploLimits =
| TLV =
| TLV-TWA =
| TLV-STEL =
| TLV-C =
| LD50 =
| LDLo =
| LC50 =
| LCLo =
| PEL =
| REL =
| IDLH =
| NIOSH_id =
| NIOSH_ref =
}}
| Template:Pre2 |
Chembox Related
This parameter list:All Related input creates a 'see also' list. It is good practice to use article links.
| Section8 = {{Chembox Related
| Related_ref =
| OtherAnions =
| OtherCations =
| OtherFunction =
| OtherFunction_label =
| OtherCompounds =
}}
|
Notes
Recently added
Template:Chembox/doc/recently added/parameter list
This parameter list:- Chembox: -
- Images:
- ImageCaptionAll, single caption below all images
- ImageCaptionLR1, ImageCaptionLR2, ImageCaptionLR3: caption below pair of images
- Names: Names_ref, pronounce
- Identifiers:
- Indexes:
- index_label, index1_label ... index5_label
- index_comment, index1_comment ... index5_comment
- indexlist_caption (default: 'Compounds')
- DTXSID, DTXSID1 ... DTXSID5, DTXSIDOther (indexed), (links to CompTox Chemistry Dashboard, U.S. EPA)
- 3DMet1, 3DMet2, 3DMet3, 3DMet4, 3DMet5, 3DMetOther (indexed)
- EC_number1, EC_number2, EC_number3, EC_number4, EC_number5, EC_numberOther (indexed)
- RTECS1, RTECS2, RTECS3, RTECS4, RTECS5, RTECSOther (indexed)
- Identifiers_ref, IUPHAR_ligand1 x5 IUPHAR_ligand1_Comment x5, IUPHAR_ligand_Other
- EC_number, EC_number_Comment
- E_number, E_number_Comment (E number)
- Jmol, Jmol1, ..., Jmol5 (overwrites
|SMILES=;none= do not show)
- Properties: Properties_ref, Formula_ref, Formula_Comment, MolarMass_ref, MolarMassUnit, MolarMass_Comment, up to the 118 elements
- ConjugateAcid, ConjugateBase
- CriticalTP
- Hazards: Hazards_ref, Hazards_data_page, NFPA_ref, NFPA_Ref, LDLo, LCLo
- Pharmacology: Pharmacology_ref, PLLR, Metabolites, DurationOfAction, OnsetOfAction
- Structure: Structure_ref, LattConst_ref, LattConst_Comment, UnitCellVolume, UnitCellFormulas
- Thermochemistry: HHV, LHV
- Explosive: Explosive_ref, DetonationV
- Related: Related_ref,
- Temperatures
Indexed parameters
- This parameter list:
CASNo
{{{CASNo1|}}}{{{CASNo2|}}}{{{CASNo3|}}}{{{CASNo4|}}}{{{CASNo5|}}}
ChEBI
{{{ChEBI1|}}}{{{ChEBI2|}}}{{{ChEBI3|}}}{{{ChEBI4|}}}{{{ChEBI5|}}}
ChEMBL
{{{ChEMBL1|}}}{{{ChEMBL2|}}}{{{ChEMBL3|}}}{{{ChEMBL4|}}}{{{ChEMBL5|}}}
ChemSpiderID
{{{ChemSpiderID1|}}}{{{ChemSpiderID2|}}}{{{ChemSpiderID3|}}}
{{{ChemSpiderID4|}}} {{{ChemSpiderID5|}}}
DrugBank
{{{DrugBank1|}}}{{{DrugBank2|}}}{{{DrugBank3|}}}{{{DrugBank4|}}}{{{DrugBank5|}}}
IUPHAR_ligand
{{{IUPHAR_ligand1|}}}{{{IUPHAR_ligand2|}}}{{{IUPHAR_ligand3|}}}{{{IUPHAR_ligand4|}}}{{{IUPHAR_ligand5|}}}
Jmol
{{{Jmol1|}}}{{{Jmol2|}}}{{{Jmol3|}}}{{{Jmol4|}}}{{{Jmol5|}}}
KEGG
{{{KEGG1|}}}{{{KEGG2|}}}{{{KEGG3|}}}{{{KEGG4|}}}{{{KEGG5|}}}
PubChem
{{{PubChem1|}}}{{{PubChem2|}}}{{{PubChem3|}}}{{{PubChem4|}}}{{{PubChem5|}}}
UNII
{{{UNII1|}}}{{{UNII2|}}}{{{UNII3|}}}{{{UNII4|}}}{{{UNII5|}}}
InChI, InChIKey
{{{InChI1|}}}{{{InIKey1|}}}{{{InChI2|}}}{{{InChIKey2|}}}{{{InChI3|}}}{{{InChIKey3|}}}{{{InChI4|}}}{{{InChIKey4|}}}{{{InChI5|}}}{{{InChIKey5|}}}
SMILES
{{{SMILES1|}}}{{{SMILES2|}}}{{{SMILES3|}}}{{{SMILES4|}}}{{{SMILES5|}}}
DTXSID
{{{DTXSID1|}}}{{{DTXSID2|}}}{{{DTXSID3|}}}{{{DTXSID4|}}}{{{DTXSID5|}}}
3DMet
{{{DTXSID1|}}}{{{DTXSID2|}}}{{{DTXSID3|}}}{{{DTXSID4|}}}{{{DTXSID5|}}}
EC_number
{{{EC_number1|}}}{{{EC_number2|}}}{{{EC_number3|}}}{{{EC_number4|}}}{{{EC_number5|}}}
RTECS
{{{RTECS1|}}}{{{RTECS2|}}}{{{RTECS3|}}}{{{RTECS4|}}}{{{RTECS5|}}}
}}<!-- {{{1|}}}{{{2|}}}{{{3|}}}{{{4|}}}{{{5|}}} -->
|
Supplement
- Is added automatically when article
{{PAGENAME (data page)exists.
More on Images
This parameter list:| Chembox image ordering () | ||
|---|---|---|
| row 1 | ImageFile | |
| row 2 | ImageFileTemplate:Purple | |
| row 3 | ImageFileTemplate:Purple | ImageFileTemplate:Purple |
| row 5 | ImageFileTemplate:Purple | |
| row 4 | ImageFileTemplate:Purple | ImageFileTemplate:Purple |
| row 6 | ImageFileTemplate:Purple | |
| row 7 | ImageFileTemplate:Purple | ImageFileTemplate:Purple |
{{Chembox
| Name =
<!-- Row 1/7 -->
|ImageFile =
|ImageSize =
|ImageAlt =
|ImageCaption =
|ImageName =
<!-- Row 2/7 -->
|ImageFile1 =
|ImageSize1 =
|ImageAlt1 =
|ImageCaption1 =
|ImageName1 =
<!-- Row 3/7 -->
|ImageFileL1 =
|ImageSizeL1 =
|ImageAltL1 =
|ImageCaptionL1 =
|ImageNameL1 =
|ImageFileR1 =
|ImageSizeR1 =
|ImageAltR1 =
|ImageCaptionR1 =
|ImageNameR1 =
|ImageCaptionLR1=
<!-- etc. for Image 2, L2 R2, 3, L3 R3 -->
|ImageCaptionAll=
| <!-- ... (more Chembox parameters) -->
}}
More on Temperatures
This parameter list:Four or less parameters are needed to present temperature data:
|
|
Decomposes when >_50 °C (122 °F; 323 K)[1]_My notes[2] |
|
The options for conversion: |
|
| Section = {{Chembox Properties
| MeltingPt =
| MeltingPtC =
| MeltingPtF =
| MeltingPtK =
| MeltingPt_ref =
| MeltingPt_notes =
| BoilingPt =
| BoilingPtC =
| BoilingPtF =
| BoilingPtK =
| BoilingPt_ref =
| BoilingPt_notes =
}}
|
| Section = {{Chembox Hazards
| FlashPt =
| FlashPtC =
| FlashPtF =
| FlashPtK =
| FlashPt_ref =
| FlashPt_notes =
| AutoignitionPt =
| AutoignitionPtC =
| AutoignitionPtF =
| AutoignitionPtK =
| AutoignitionPt_ref =
| AutoignitionPt_notes =
}}
|
Deprecations
This parameter list:Incomplete list
ATC and Drugbank: Parameters |ATC= and |Drugbank= can appear in only one section each:
- in
|Section1 = {{Chembox Identifiers |Drugbank = ...}} - in
|Section2 = {{Chembox Pharamacology |ATCCode = ...}}
- Preferred alternative parameters
- Names: PIN_hidden, IUPACName_hidden (not used)
- Identifiers: EC-number → EC_number
- Identifiers: EINECS deprecated, can be used, same as EC_number
- Identifiers: CASNos → CASNoOther
- All eight similar: CASNos, ChEMBLs, ChemSpiderIDs, ChEbIs, InChIs, PubChems, SMILESs, UNIIs
- PubChem_Ref not used
- EINECSCASNO removed
- Explosive: ExplosiveV → DetonationV
- Pharma: ATCCode → split over ATCCode_prefix ATCCode_suffix (3 + 4 characters)
- Pharma: PregCat → Pregnancy_category
- Pharma: PregCat_AU, PregCat_US → Pregnancy_category_AU, Pregnancy_category_US
- Pharma: legal_XX → Legal_XX uppercase L
- Hazards: ExternalMSDS → ExternalSDS
- Hazards: NSFA_Ref → NSFA_ref
- Hazards: EUIndex removed from template
- Hazards: NFPA-O → NFPA-S (NFPA-704 Special, not Other)
- Thermodynamics: DeltaHf → DeltaHForm
- Thermodynamics: DeltaGf → DeltaGfree
- Thermodynamics: DeltaHc → DeltaHCombust
- Properties: MassRound → MolarMassRound (into regular name pattern)
- Properties: ExactMass not available in templatediscussed 2012
- Related function: OtherFunctn use OtherFunction
- Related function: Function use OtherFunction_label
- Related function: OtherCpds use OtherCompounds
- Parameters deprecated earlier: Section, Section10, ImageStyleN