Geometry & MOs

Info

ID:	124286
PubChem CID:	50877073
Reduced:	ClON2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	222.055991
ΔH_f, kcal/mol:	-13.75
Dipole, Da:	2.93
IP(EA), eV:	-9.17(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-1-propylbenzimidazole-2-carbaldehyde

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C=C2)Cl)N=C1C(=O)C

DOS

IR

Vibrations