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

C4H16Cl2N5O3Rh — CID 170843822

IUPACbis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate
SMILESNCCN.NCCN.O=[N+]([O-])[O-].[Cl-].[Cl-].[Rh+3]
InChIInChI=1S/2C2H8N2.2ClH.NO3.Rh/c2*3-1-2-4;;;2-1(3)4;/h2*1-4H2;2*1H;;/q;;;;-1;+3/p-2
InChIKeyHFSXEEAFYJNPOE-UHFFFAOYSA-L
MW356.02 g/mol
LogP-8.43
Rot. Bonds2

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

bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate (PubChem CID 170843822) has the molecular formula C4H16Cl2N5O3Rh and a molecular weight of 356.02 g/mol. Its IUPAC name is bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate.

Molecular Properties

Compound Namebis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate
PubChem CID170843822
Molecular FormulaC4H16Cl2N5O3Rh
Molecular Weight356.02 g/mol
Exact Mass354.97
IUPAC Namebis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate
SMILESNCCN.NCCN.O=[N+]([O-])[O-].[Cl-].[Cl-].[Rh+3]
InChIInChI=1S/2C2H8N2.2ClH.NO3.Rh/c2*3-1-2-4;;;2-1(3)4;/h2*1-4H2;2*1H;;/q;;;;-1;+3/p-2
InChIKeyHFSXEEAFYJNPOE-UHFFFAOYSA-L
XLogP-8.43
TPSA170.28 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.02
LogP ≤ 5-8.43
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate?
The IUPAC name of bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate (CID 170843822) is bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate.
What is the SMILES notation for bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate?
The canonical SMILES for bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate is NCCN.NCCN.O=[N+]([O-])[O-].[Cl-].[Cl-].[Rh+3].
What is the InChIKey of bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate?
The InChIKey is HFSXEEAFYJNPOE-UHFFFAOYSA-L. The full InChI is InChI=1S/2C2H8N2.2ClH.NO3.Rh/c2*3-1-2-4;;;2-1(3)4;/h2*1-4H2;2*1H;;/q;;;;-1;+3/p-2.
What are the key properties of bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate?
bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate has a molecular weight of 356.02 g/mol, XLogP of -8.43, 2 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethane-1,2-diamine);rhodium(3+);dichloride;nitrate is sourced from PubChem (CID 170843822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).