Geometry & MOs

Info

ID:	240329
PubChem CID:	93576949
Reduced:	O2N3C21H23 (1)
Stoich.:	A2B3C21D23 (1)
Weight, g/mol:	341.12949
ΔH_f, kcal/mol:	-25.44
Dipole, Da:	3.43
IP(EA), eV:	-8.82(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-2-[2-(4-chlorophenyl)benzimidazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3N2CC(=O)NC[C@H]4CCCO4

DOS

IR

Vibrations