Geometry & MOs

Info

ID:	240120
PubChem CID:	93576217
Reduced:	O2N4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	392.221226
ΔH_f, kcal/mol:	-81.37
Dipole, Da:	3.64
IP(EA), eV:	-9.06(-0.29)
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]butanamide

Drug info:

PubChemData

Smile

CCCC(=O)NCCC1=NC2=CC=CC=C2N1CC(=O)N[C@H](C)CC

DOS

IR

Vibrations