Geometry & MOs

Info

ID:	295314
PubChem CID:	117526214
Reduced:	NC4H5 (3)
Stoich.:	AB4C5 (3)
Weight, g/mol:	213.126598
ΔH_f, kcal/mol:	49.7
Dipole, Da:	3.72
IP(EA), eV:	-8.84(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(azetidin-3-yl)-2-cyclopropyl-1H-benzimidazole

Drug info:

PubChemData

Smile

CCC1=NC2=C(N1)C=C(C=C2)C3CNC3

DOS

IR

Vibrations