Geometry & MOs

Info

ID:	347576
PubChem CID:	127272431
Reduced:	SO2N3C20H23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	341.210327
ΔH_f, kcal/mol:	-30.08
Dipole, Da:	2.55
IP(EA), eV:	-8.55(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-anilinopyrrolidine-1-carbonyl)-1-cyclopentylpyrrolidin-2-one

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)C(=O)C2=CC=CS2)C(=O)N3CCC(C3)NC4=CC=CC=C4

DOS

IR

Vibrations