Geometry & MOs

Info

ID:	358680
PubChem CID:	127296470
Reduced:	SO2N3C20H23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	300.183778
ΔH_f, kcal/mol:	-53.1
Dipole, Da:	6.26
IP(EA), eV:	-9.3(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-5-oxo-N-[(4-phenylcyclohexyl)methyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CCC1CNC(=O)C2=CN=C3N(C2=O)CCS3)C4=CC=CC=C4

DOS

IR

Vibrations