chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)

C44H40AuClN8P4 — CID 15166408

IUPACchlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)
SMILESCl[Au].c1ccc(P(CCP(c2ccccn2)c2ccccn2)c2ccccn2)nc1.c1ccc(P(CCP(c2ccccn2)c2ccccn2)c2ccccn2)nc1
InChIInChI=1S/2C22H20N4P2.Au.ClH/c2*1-5-13-23-19(9-1)27(20-10-2-6-14-24-20)17-18-28(21-11-3-7-15-25-21)22-12-4-8-16-26-22;;/h2*1-16H,17-18H2;;1H/q;;+1;/p-1
InChIKeyWKLYNEIWQGGUMS-UHFFFAOYSA-M
MW1037.18 g/mol
LogP6.35
Rot. Bonds14

About chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)

chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane) (PubChem CID 15166408) has the molecular formula C44H40AuClN8P4 and a molecular weight of 1037.18 g/mol. Its IUPAC name is chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane).

Molecular Properties

Compound Namechlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)
PubChem CID15166408
Molecular FormulaC44H40AuClN8P4
Molecular Weight1037.18 g/mol
Exact Mass1036.17
IUPAC Namechlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)
SMILESCl[Au].c1ccc(P(CCP(c2ccccn2)c2ccccn2)c2ccccn2)nc1.c1ccc(P(CCP(c2ccccn2)c2ccccn2)c2ccccn2)nc1
InChIInChI=1S/2C22H20N4P2.Au.ClH/c2*1-5-13-23-19(9-1)27(20-10-2-6-14-24-20)17-18-28(21-11-3-7-15-25-21)22-12-4-8-16-26-22;;/h2*1-16H,17-18H2;;1H/q;;+1;/p-1
InChIKeyWKLYNEIWQGGUMS-UHFFFAOYSA-M
XLogP6.35
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds14
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001037.18
LogP ≤ 56.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

bromogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)
CID 88596830
chlororuthenium;tris(diphenyl(pyridin-2-yl)phosphane)
CID 11147372
diphenyl(pyridin-2-yl)phosphane
CID 621893
bis(2-chlorophenyl)-pyridin-2-ylphosphane
CID 21284230
6-[(5-formyl-2-pyridinyl)-pyridin-2-ylphosphanyl]pyridine-3-carbaldehyde
CID 146390094
tert-butyl-[(2-ethylphenyl)methyl]-pyridin-2-ylphosphane
CID 164765935
bis(4-methylphenyl)-pyridin-2-ylphosphane
CID 21284190
cyclopentyl(dipyridin-2-yl)phosphane
CID 126497392
bis(4-fluorophenyl)-pyridin-2-ylphosphane
CID 87213257
2-(2-chloroethoxy)pyridine
CID 22624993
tert-butyl-[2-[[tert-butyl(pyridin-2-yl)phosphanyl]methyl]phenyl]-pyridin-2-ylphosphane
CID 126492794
tert-butyl-cyclopenta-2,4-dien-1-yl-pyridin-2-ylphosphane
CID 126497398

Frequently Asked Questions

What is the IUPAC name of chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)?
The IUPAC name of chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane) (CID 15166408) is chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane).
What is the SMILES notation for chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)?
The canonical SMILES for chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane) is Cl[Au].c1ccc(P(CCP(c2ccccn2)c2ccccn2)c2ccccn2)nc1.c1ccc(P(CCP(c2ccccn2)c2ccccn2)c2ccccn2)nc1.
What is the InChIKey of chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)?
The InChIKey is WKLYNEIWQGGUMS-UHFFFAOYSA-M. The full InChI is InChI=1S/2C22H20N4P2.Au.ClH/c2*1-5-13-23-19(9-1)27(20-10-2-6-14-24-20)17-18-28(21-11-3-7-15-25-21)22-12-4-8-16-26-22;;/h2*1-16H,17-18H2;;1H/q;;+1;/p-1.
What are the key properties of chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane)?
chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane) has a molecular weight of 1037.18 g/mol, XLogP of 6.35, 14 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for chlorogold;bis(2-dipyridin-2-ylphosphanylethyl(dipyridin-2-yl)phosphane) is sourced from PubChem (CID 15166408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).