Geometry & MOs

Info

ID:	240264
PubChem CID:	93576737
Reduced:	ON3C29H33 (1)
Stoich.:	AB3C29D33 (1)
Weight, g/mol:	455.257277
ΔH_f, kcal/mol:	12.63
Dipole, Da:	1.96
IP(EA), eV:	-9.02(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methoxyphenyl)methyl]-2-[2-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]benzimidazol-1-yl]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)CC(C)C)C2=NC3=CC=CC=C3N2CC(=O)N[C@H](C)C4=CC=CC=C4

DOS

IR

Vibrations