bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide

C6H16AuCl2N6Rh — CID 170853703

IUPACbis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide
SMILESNCCN.NCCN.[Au+].[C-]#N.[C-]#N.[Cl-].[Cl-].[Rh+3]
InChIInChI=1S/2C2H8N2.2CN.Au.2ClH.Rh/c2*3-1-2-4;2*1-2;;;;/h2*1-4H2;;;;2*1H;/q;;2*-1;+1;;;+3/p-2
InChIKeyDGJPFUOJJSSMPF-UHFFFAOYSA-L
MW543.02 g/mol
LogP-8.00
Rot. Bonds2

About bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide

bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide (PubChem CID 170853703) has the molecular formula C6H16AuCl2N6Rh and a molecular weight of 543.02 g/mol. Its IUPAC name is bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide.

Molecular Properties

Compound Namebis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide
PubChem CID170853703
Molecular FormulaC6H16AuCl2N6Rh
Molecular Weight543.02 g/mol
Exact Mass541.95
IUPAC Namebis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide
SMILESNCCN.NCCN.[Au+].[C-]#N.[C-]#N.[Cl-].[Cl-].[Rh+3]
InChIInChI=1S/2C2H8N2.2CN.Au.2ClH.Rh/c2*3-1-2-4;2*1-2;;;;/h2*1-4H2;;;;2*1H;/q;;2*-1;+1;;;+3/p-2
InChIKeyDGJPFUOJJSSMPF-UHFFFAOYSA-L
XLogP-8.00
TPSA151.66 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500543.02
LogP ≤ 5-8.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide?
The IUPAC name of bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide (CID 170853703) is bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide.
What is the SMILES notation for bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide?
The canonical SMILES for bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide is NCCN.NCCN.[Au+].[C-]#N.[C-]#N.[Cl-].[Cl-].[Rh+3].
What is the InChIKey of bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide?
The InChIKey is DGJPFUOJJSSMPF-UHFFFAOYSA-L. The full InChI is InChI=1S/2C2H8N2.2CN.Au.2ClH.Rh/c2*3-1-2-4;2*1-2;;;;/h2*1-4H2;;;;2*1H;/q;;2*-1;+1;;;+3/p-2.
What are the key properties of bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide?
bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide has a molecular weight of 543.02 g/mol, XLogP of -8.00, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethane-1,2-diamine);gold(1+);rhodium(3+);dichloride;dicyanide is sourced from PubChem (CID 170853703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).