bis(1-N',2-N'-dihydroxyethanediimidamide);platinum

C4H12N8O4Pt — CID 135460051

IUPACbis(1-N',2-N'-dihydroxyethanediimidamide);platinum
SMILESNC(=NO)C(N)=NO.NC(=NO)C(N)=NO.[Pt]
InChIInChI=1S/2C2H6N4O2.Pt/c2*3-1(5-7)2(4)6-8;/h2*7-8H,(H2,3,5)(H2,4,6);
InChIKeyHJMASQKCCMDTFO-UHFFFAOYSA-N
MW431.27 g/mol
LogP-3.04
Rot. Bonds

About bis(1-N',2-N'-dihydroxyethanediimidamide);platinum

bis(1-N',2-N'-dihydroxyethanediimidamide);platinum (PubChem CID 135460051) has the molecular formula C4H12N8O4Pt and a molecular weight of 431.27 g/mol. Its IUPAC name is bis(1-N',2-N'-dihydroxyethanediimidamide);platinum.

Molecular Properties

Compound Namebis(1-N',2-N'-dihydroxyethanediimidamide);platinum
PubChem CID135460051
Molecular FormulaC4H12N8O4Pt
Molecular Weight431.27 g/mol
Exact Mass431.06
IUPAC Namebis(1-N',2-N'-dihydroxyethanediimidamide);platinum
SMILESNC(=NO)C(N)=NO.NC(=NO)C(N)=NO.[Pt]
InChIInChI=1S/2C2H6N4O2.Pt/c2*3-1(5-7)2(4)6-8;/h2*7-8H,(H2,3,5)(H2,4,6);
InChIKeyHJMASQKCCMDTFO-UHFFFAOYSA-N
XLogP-3.04
TPSA234.44 Ų
H-Bond Donors8
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.27
LogP ≤ 5-3.04
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', '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(1-N',2-N'-dihydroxyethanediimidamide);platinum?
The IUPAC name of bis(1-N',2-N'-dihydroxyethanediimidamide);platinum (CID 135460051) is bis(1-N',2-N'-dihydroxyethanediimidamide);platinum.
What is the SMILES notation for bis(1-N',2-N'-dihydroxyethanediimidamide);platinum?
The canonical SMILES for bis(1-N',2-N'-dihydroxyethanediimidamide);platinum is NC(=NO)C(N)=NO.NC(=NO)C(N)=NO.[Pt].
What is the InChIKey of bis(1-N',2-N'-dihydroxyethanediimidamide);platinum?
The InChIKey is HJMASQKCCMDTFO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H6N4O2.Pt/c2*3-1(5-7)2(4)6-8;/h2*7-8H,(H2,3,5)(H2,4,6);.
What are the key properties of bis(1-N',2-N'-dihydroxyethanediimidamide);platinum?
bis(1-N',2-N'-dihydroxyethanediimidamide);platinum has a molecular weight of 431.27 g/mol, XLogP of -3.04, 0 rotatable bonds, 8 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-N',2-N'-dihydroxyethanediimidamide);platinum is sourced from PubChem (CID 135460051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).