Geometry & MOs

Info

ID:	240110
PubChem CID:	93576180
Reduced:	O3N4C19H20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	402.169191
ΔH_f, kcal/mol:	-23.81
Dipole, Da:	4.2
IP(EA), eV:	-9.4(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-[1-[2-(benzylamino)-2-oxoethyl]benzimidazol-2-yl]ethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=CC=CC=C2N1CC(=O)NCC=C)NC(=O)C3=CC=CO3

DOS

IR

Vibrations