bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride

C60H52Cl8Fe2N2P2Pt2 — CID 139075997

IUPACbis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride
SMILESC(=N\c1ccccc1P(c1ccccc1)c1ccccc1)\c1ccc[cH-]1.C(=N\c1ccccc1P(c1ccccc1)c1ccccc1)\c1ccc[cH-]1.ClCCl.ClCCl.[Cl-].[Cl-].[Cl-].[Cl-].[Fe+2].[Fe+2].[Pt+2].[Pt+2].c1cc[cH-]c1.c1cc[cH-]c1
InChIInChI=1S/2C24H19NP.2C5H5.2CH2Cl2.4ClH.2Fe.2Pt/c2*1-3-13-21(14-4-1)26(22-15-5-2-6-16-22)24-18-10-9-17-23(24)25-19-20-11-7-8-12-20;2*1-2-4-5-3-1;2*2-1-3;;;;;;;;/h2*1-19H;2*1-5H;2*1H2;4*1H;;;;/q4*-1;;;;;;;4*+2/p-4/b2*25-19-;;;;;;;;;;;;
InChIKeyXQJCNQYJLZSPQV-DLFDDCLNSA-J
MW1648.51 g/mol
LogP3.49
Rot. Bonds10

About bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride

bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride (PubChem CID 139075997) has the molecular formula C60H52Cl8Fe2N2P2Pt2 and a molecular weight of 1648.51 g/mol. Its IUPAC name is bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride.

Molecular Properties

Compound Namebis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride
PubChem CID139075997
Molecular FormulaC60H52Cl8Fe2N2P2Pt2
Molecular Weight1648.51 g/mol
Exact Mass1643.91
IUPAC Namebis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride
SMILESC(=N\c1ccccc1P(c1ccccc1)c1ccccc1)\c1ccc[cH-]1.C(=N\c1ccccc1P(c1ccccc1)c1ccccc1)\c1ccc[cH-]1.ClCCl.ClCCl.[Cl-].[Cl-].[Cl-].[Cl-].[Fe+2].[Fe+2].[Pt+2].[Pt+2].c1cc[cH-]c1.c1cc[cH-]c1
InChIInChI=1S/2C24H19NP.2C5H5.2CH2Cl2.4ClH.2Fe.2Pt/c2*1-3-13-21(14-4-1)26(22-15-5-2-6-16-22)24-18-10-9-17-23(24)25-19-20-11-7-8-12-20;2*1-2-4-5-3-1;2*2-1-3;;;;;;;;/h2*1-19H;2*1-5H;2*1H2;4*1H;;;;/q4*-1;;;;;;;4*+2/p-4/b2*25-19-;;;;;;;;;;;;
InChIKeyXQJCNQYJLZSPQV-DLFDDCLNSA-J
XLogP3.49
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms76
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5001648.51
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-diphenylphosphanylphenyl)-1-phenylmethanimine
CID 10995682
N-(2-diphenylphosphanylphenyl)-1-phenylmethanimine
CID 139103390
azane;cyclopenta-1,3-diene;cyclopenta-1,3-dien-1-yl(diphenyl)phosphane;iron(2+)
CID 175727216
N-(2-diphenylphosphanylphenyl)-1-thiophen-2-ylmethanimine
CID 102246105
acetonitrile;carbanide;N-(2-diphenylphosphanylphenyl)-1-phenylmethanimine;palladium(2+);tetrafluoroborate
CID 10995681
5-bromo-2-[(2-diphenylphosphanylphenyl)iminomethyl]phenol
CID 136784137
1-[2-bis(2-methoxyphenyl)phosphanylphenyl]-N-(2-diphenylphosphanylphenyl)methanimine
CID 101383931
[3-chloro-2-(2-chloro-6-diphenylphosphanylphenyl)phenyl]-diphenylphosphane
CID 22415599
dichloropalladium;1-(2-diphenylphosphanylphenyl)-N-[2-(trifluoromethyl)phenyl]methanimine
CID 139240542
(2-diphenylphosphanylphenyl)-diphenylphosphane;titanium
CID 174974517
[2-(chloromethyl)phenyl]-diphenylphosphane;hydrochloride
CID 172706250
(4-chlorophenyl)-(2-diphenylphosphanylphenyl)diazene
CID 101442398

Frequently Asked Questions

What is the IUPAC name of bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride?
The IUPAC name of bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride (CID 139075997) is bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride.
What is the SMILES notation for bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride?
The canonical SMILES for bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride is C(=N\c1ccccc1P(c1ccccc1)c1ccccc1)\c1ccc[cH-]1.C(=N\c1ccccc1P(c1ccccc1)c1ccccc1)\c1ccc[cH-]1.ClCCl.ClCCl.[Cl-].[Cl-].[Cl-].[Cl-].[Fe+2].[Fe+2].[Pt+2].[Pt+2].c1cc[cH-]c1.c1cc[cH-]c1.
What is the InChIKey of bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride?
The InChIKey is XQJCNQYJLZSPQV-DLFDDCLNSA-J. The full InChI is InChI=1S/2C24H19NP.2C5H5.2CH2Cl2.4ClH.2Fe.2Pt/c2*1-3-13-21(14-4-1)26(22-15-5-2-6-16-22)24-18-10-9-17-23(24)25-19-20-11-7-8-12-20;2*1-2-4-5-3-1;2*2-1-3;;;;;;;;/h2*1-19H;2*1-5H;2*1H2;4*1H;;;;/q4*-1;;;;;;;4*+2/p-4/b2*25-19-;;;;;;;;;;;;.
What are the key properties of bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride?
bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride has a molecular weight of 1648.51 g/mol, XLogP of 3.49, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(cyclopenta-1,3-diene);bis(1-cyclopenta-1,3-dien-1-yl-N-(2-diphenylphosphanylphenyl)methanimine);bis(dichloromethane);bis(iron(2+));bis(platinum(2+));tetrachloride is sourced from PubChem (CID 139075997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).