Geometry & MOs

Info

ID:	240151
PubChem CID:	93576385
Reduced:	ClO3N4C23H25 (1)
Stoich.:	AB3C4D23E25 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-67.99
Dipole, Da:	4.91
IP(EA), eV:	-9.3(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-acetamidopropyl)benzimidazol-1-yl]-N-[(1S)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CNC(=O)CN2C3=CC=CC=C3N=C2CCNC(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations