Geometry & MOs

Info

ID:	161499
PubChem CID:	57391822
Reduced:	NCl2O3C26H31 (1)
Stoich.:	AB2C3D26E31 (1)
Weight, g/mol:	282.069054
ΔH_f, kcal/mol:	-127.21
Dipole, Da:	3.17
IP(EA), eV:	-8.65(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dichloro-1-cyclopentyl-2-ethylbenzimidazole

Drug info:

PubChemData

Smile

CC1=C(CCC2=C1C=CC(=C2)OC[C@@H](C)CC3=CC=C(C=C3)Cl)CN4CC(C4)C(=O)O.Cl

DOS

IR

Vibrations