Geometry & MOs

Info

ID:	240177
PubChem CID:	93576490
Reduced:	O3N4C25H30 (1)
Stoich.:	A3B4C25D30 (1)
Weight, g/mol:	382.200491
ΔH_f, kcal/mol:	-93.78
Dipole, Da:	8.09
IP(EA), eV:	-8.67(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[1-[2-[[(2R)-butan-2-yl]amino]-2-oxoethyl]benzimidazol-2-yl]propyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)NC(=O)CN2C3=CC=CC=C3N=C2CCCNC(=O)[C@@H]4CCCO4)C

DOS

IR

Vibrations