Geometry & MOs

Info

ID:	240241
PubChem CID:	93576707
Reduced:	BrON3C27H28 (1)
Stoich.:	ABC3D27E28 (1)
Weight, g/mol:	441.241627
ΔH_f, kcal/mol:	24.57
Dipole, Da:	3.36
IP(EA), eV:	-9.15(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxyphenyl)-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)NC4=CC=C(C=C4)Br

DOS

IR

Vibrations