Geometry & MOs

Info

ID:	313600
PubChem CID:	126616265
Reduced:	OCl2N2H24C30 (1)
Stoich.:	AB2C2D24E30 (1)
Weight, g/mol:	584.174582
ΔH_f, kcal/mol:	69.25
Dipole, Da:	4.77
IP(EA), eV:	-8.95(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[6-[bis(4-chlorophenyl)methyl]-2-pyridin-3-ylbenzimidazol-1-yl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C1CC1C2=NC3=C(N2CC4=CC(=CC=C4)O)C=C(C=C3)C(C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl

DOS

IR

Vibrations