Geometry & MOs

Info

ID:	155770
PubChem CID:	56367471
Reduced:	SO4N6C23H30 (1)
Stoich.:	AB4C6D23E30 (1)
Weight, g/mol:	380.184841
ΔH_f, kcal/mol:	-106.55
Dipole, Da:	7.83
IP(EA), eV:	-9.36(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)-5-oxo-N-[3-oxo-3-(pyridin-4-ylmethylamino)propyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NCCC(=O)NCC3=CC=NC=C3

DOS

IR

Vibrations