Geometry & MOs

Info

ID:	295361
PubChem CID:	117527294
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	230.105528
ΔH_f, kcal/mol:	-65.57
Dipole, Da:	8.22
IP(EA), eV:	-8.83(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,2-dimethylbenzimidazol-5-yl)cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=NC2=C(N1C)C=CC(=C2)CC(C)C(=O)O

DOS

IR

Vibrations