Geometry & MOs

Info

ID:	175524
PubChem CID:	75916541
Reduced:	N3O5C24H29 (1)
Stoich.:	A3B5C24D29 (1)
Weight, g/mol:	450.215472
ΔH_f, kcal/mol:	-193.46
Dipole, Da:	4.55
IP(EA), eV:	-8.34(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(1,3-benzodioxol-5-yl)oxan-4-yl]methyl]-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)N2CC(CC2=O)C(=O)NC3=CC(=CC=C3)NC(=O)OCC(C)C

DOS

IR

Vibrations