Geometry & MOs

Info

ID:	140765
PubChem CID:	52755749
Reduced:	N3O4H21C22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	391.153206
ΔH_f, kcal/mol:	-66.09
Dipole, Da:	1.63
IP(EA), eV:	-8.62(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-[(3S)-5-oxo-1-(4-phenoxyphenyl)pyrrolidin-3-yl]-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(=O)N[C@@H]2CC(=O)N(C2)C3=CC=C(C=C3)OC4=CC=CC=C4

DOS

IR

Vibrations