Geometry & MOs

Info

ID:	246931
PubChem CID:	103065669
Reduced:	ClNO2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	234.092376
ΔH_f, kcal/mol:	-39.26
Dipole, Da:	4.7
IP(EA), eV:	-9.07(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(chloromethyl)prop-2-enyl]-5,6-dimethylbenzimidazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C(=O)C2=O)CC(=C)CCl

DOS

IR

Vibrations