lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide

C26H60Co2LiN14 — CID 157235465

IUPAClithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide
SMILESC[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=[C-]/C(C)(C)C.[Co+2].[Co+3].[Li+]
InChIInChI=1S/C6H12N2.4C5H12N3.2Co.Li/c1-6(2,3)5-8-7-4;4*1-5(2,3)7-8-6-4;;;/h5*1-4H3;;;/q-2;4*-1;+2;+3;+1
InChIKeyXVDGIOKEAFRNTB-UHFFFAOYSA-N
MW693.67 g/mol
LogP7.52
Rot. Bonds5

About lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide

lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide (PubChem CID 157235465) has the molecular formula C26H60Co2LiN14 and a molecular weight of 693.67 g/mol. Its IUPAC name is lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide.

Molecular Properties

Compound Namelithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide
PubChem CID157235465
Molecular FormulaC26H60Co2LiN14
Molecular Weight693.67 g/mol
Exact Mass693.39
IUPAC Namelithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide
SMILESC[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=[C-]/C(C)(C)C.[Co+2].[Co+3].[Li+]
InChIInChI=1S/C6H12N2.4C5H12N3.2Co.Li/c1-6(2,3)5-8-7-4;4*1-5(2,3)7-8-6-4;;;/h5*1-4H3;;;/q-2;4*-1;+2;+3;+1
InChIKeyXVDGIOKEAFRNTB-UHFFFAOYSA-N
XLogP7.52
TPSA181.74 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500693.67
LogP ≤ 57.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide 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 lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide?
The IUPAC name of lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide (CID 157235465) is lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide.
What is the SMILES notation for lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide?
The canonical SMILES for lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide is C[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=N/C(C)(C)C.C[N-]/N=[C-]/C(C)(C)C.[Co+2].[Co+3].[Li+].
What is the InChIKey of lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide?
The InChIKey is XVDGIOKEAFRNTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2.4C5H12N3.2Co.Li/c1-6(2,3)5-8-7-4;4*1-5(2,3)7-8-6-4;;;/h5*1-4H3;;;/q-2;4*-1;+2;+3;+1.
What are the key properties of lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide?
lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide has a molecular weight of 693.67 g/mol, XLogP of 7.52, 5 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;tetrakis((tert-butyldiazenyl)-methylazanide);cobalt(2+);cobalt(3+);(2,2-dimethylpropylideneamino)-methylazanide is sourced from PubChem (CID 157235465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).