Geometry & MOs

Info

ID:	426782
PubChem CID:	135153860
Reduced:	O2N3C12H13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	271.106925
ΔH_f, kcal/mol:	-27.04
Dipole, Da:	4.56
IP(EA), eV:	-8.75(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-cyano-2-oxo-3H-benzimidazol-1-yl)cyclobutane-1-carbohydrazide

Drug info:

PubChemData

Smile

C1C(CC1NC2=C(C=C(C=C2)C#N)N)C(=O)O

DOS

IR

Vibrations