Geometry & MOs

Info

ID:	240105
PubChem CID:	93576152
Reduced:	FO3N4H19C22 (1)
Stoich.:	AB3C4D19E22 (1)
Weight, g/mol:	432.179755
ΔH_f, kcal/mol:	-64.07
Dipole, Da:	4.03
IP(EA), eV:	-9.17(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-[1-[2-(4-ethoxyanilino)-2-oxoethyl]benzimidazol-2-yl]ethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=CC=CC=C2N1CC(=O)NC3=CC=C(C=C3)F)NC(=O)C4=CC=CO4

DOS

IR

Vibrations