Geometry & MOs

Info

ID:	240114
PubChem CID:	93576200
Reduced:	O2N4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	330.205576
ΔH_f, kcal/mol:	-37.57
Dipole, Da:	2.67
IP(EA), eV:	-8.85(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[1-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)NC(=O)CN2C3=CC=CC=C3N=C2CCNC(=O)C

DOS

IR

Vibrations