Geometry & MOs

Info

ID:	151691
PubChem CID:	56261152
Reduced:	SO2N5C19H19 (1)
Stoich.:	AB2C5D19E19 (1)
Weight, g/mol:	415.156577
ΔH_f, kcal/mol:	8.55
Dipole, Da:	7.78
IP(EA), eV:	-9.57(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-[2-[(2-phenylacetyl)amino]ethyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2=NC=CC=N2)C(=O)NCCNC(=O)CC3=CC=CC=C3

DOS

IR

Vibrations