Geometry & MOs

Info

ID:

174

PubChem CID:

2233

Reduced:

ON5C6H16 (1)

Stoich.:

AB5C6D16 (1)

Weight, g/mol:

174.135485

ΔHf, kcal/mol:

-35.53

Dipole, Da:

3.25

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.754933

Charge, e:

 1

Chem-info

IUPAC name:

diaminomethylidene-(4,5-diamino-5-oxopentyl)azanium

Drug info:

PubChemData

Smile

C(CC(C(=O)N)N)C[NH+]=C(N)N

DOS

IR

Vibrations