Geometry & MOs

Info

ID:	240070
PubChem CID:	93576022
Reduced:	N4O4C23H26 (1)
Stoich.:	A4B4C23D26 (1)
Weight, g/mol:	436.211055
ΔH_f, kcal/mol:	-110.4
Dipole, Da:	4.04
IP(EA), eV:	-8.29(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[(1R)-1-[1-[2-(4-ethoxyanilino)-2-oxoethyl]benzimidazol-2-yl]ethyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=CC=CC=C2N1CC(=O)NC3=CC=C(C=C3)OC)NC(=O)[C@H]4CCCO4

DOS

IR

Vibrations