Geometry & MOs

Info

ID:	138373
PubChem CID:	52357094
Reduced:	NSO3C20H23 (1)
Stoich.:	ABC3D20E23 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-82.64
Dipole, Da:	7.11
IP(EA), eV:	-9.57(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(2-ethoxyphenyl)methyl]-1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2(CC2)C(=O)N[C@@H](C)C3=CC=C(C=C3)S(=O)(=O)C

DOS

IR

Vibrations