Geometry & MOs

Info

ID:	240339
PubChem CID:	93576972
Reduced:	O2N3C17H23 (1)
Stoich.:	A2B3C17D23 (1)
Weight, g/mol:	301.179027
ΔH_f, kcal/mol:	-64.52
Dipole, Da:	4.22
IP(EA), eV:	-8.9(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-butan-2-yl]-2-[2-[(2S)-oxolan-2-yl]benzimidazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CC[C@@H](C)NC(=O)CN1C2=CC=CC=C2N=C1[C@@H]3CCCO3

DOS

IR

Vibrations