Geometry & MOs

Info

ID:	313616
PubChem CID:	126616646
Reduced:	O2N3C28H39 (1)
Stoich.:	A2B3C28D39 (1)
Weight, g/mol:	584.163348
ΔH_f, kcal/mol:	-85.96
Dipole, Da:	4.55
IP(EA), eV:	-9.48(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3-[[6-[bis(4-chlorophenyl)methyl]-2-cyclopropylbenzimidazol-1-yl]methyl]phenoxy]acetate

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H]([C@@H](C1)C(=O)NC[C@H](C2=CC=CC=C2)NC(=O)[C@H](CC3=CC=CC=C3)N)C(C)C

DOS

IR

Vibrations