Geometry & MOs

Info

ID:	240126
PubChem CID:	93576276
Reduced:	N4O4C23H26 (1)
Stoich.:	A4B4C23D26 (1)
Weight, g/mol:	420.216141
ΔH_f, kcal/mol:	-103.21
Dipole, Da:	5.06
IP(EA), eV:	-8.76(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[2-[1-[2-(2-ethylanilino)-2-oxoethyl]benzimidazol-2-yl]ethyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(=O)CN2C3=CC=CC=C3N=C2CCNC(=O)[C@@H]4CCCO4

DOS

IR

Vibrations