Geometry & MOs

Info

ID:	240115
PubChem CID:	93576205
Reduced:	ON2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-80.63
Dipole, Da:	8.15
IP(EA), eV:	-8.65(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[1-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzimidazol-2-yl]ethyl]propanamide

Drug info:

PubChemData

Smile

CC[C@H](C)NC(=O)CN1C2=CC=CC=C2N=C1CCNC(=O)CC

DOS

IR

Vibrations