CID 173445296

H6CuI2N3P — CID 173445296

IUPAC—
SMILESI[Cu]I.NP(N)N
InChIInChI=1S/Cu.2HI.H6N3P/c;;;1-4(2)3/h;2*1H;1-3H2/q+2;;;/p-2
InChIKeyJDFPHCVQBBKCPF-UHFFFAOYSA-L
MW396.40 g/mol
LogP0.86
Rot. Bonds

About CID 173445296

CID 173445296 (PubChem CID 173445296) has the molecular formula H6CuI2N3P and a molecular weight of 396.40 g/mol.

Molecular Properties

Compound NameCID 173445296
PubChem CID173445296
Molecular FormulaH6CuI2N3P
Molecular Weight396.40 g/mol
Exact Mass395.77
IUPAC Name—
SMILESI[Cu]I.NP(N)N
InChIInChI=1S/Cu.2HI.H6N3P/c;;;1-4(2)3/h;2*1H;1-3H2/q+2;;;/p-2
InChIKeyJDFPHCVQBBKCPF-UHFFFAOYSA-L
XLogP0.86
TPSA78.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.40
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 173445296?
The IUPAC name of CID 173445296 (CID 173445296) is not available.
What is the SMILES notation for CID 173445296?
The canonical SMILES for CID 173445296 is I[Cu]I.NP(N)N.
What is the InChIKey of CID 173445296?
The InChIKey is JDFPHCVQBBKCPF-UHFFFAOYSA-L. The full InChI is InChI=1S/Cu.2HI.H6N3P/c;;;1-4(2)3/h;2*1H;1-3H2/q+2;;;/p-2.
What are the key properties of CID 173445296?
CID 173445296 has a molecular weight of 396.40 g/mol, XLogP of 0.86, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173445296 is sourced from PubChem (CID 173445296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).