Geometry & MOs

Info

ID:	240154
PubChem CID:	93576395
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	358.236876
ΔH_f, kcal/mol:	-114.15
Dipole, Da:	2.86
IP(EA), eV:	-9.08(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[1-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]benzimidazol-2-yl]propyl]-2-methylpropanamide

Drug info:

PubChemData

Smile

CCC(=O)NCCCC1=NC2=CC=CC=C2N1CC(=O)NC[C@H]3CCCO3

DOS

IR

Vibrations