Geometry & MOs

Info

ID:	170800
PubChem CID:	75281502
Reduced:	FSN2O6C27H27 (1)
Stoich.:	ABC2D6E27F27 (1)
Weight, g/mol:	382.180504
ΔH_f, kcal/mol:	-200.82
Dipole, Da:	5.45
IP(EA), eV:	-8.39(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-fluorophenyl)-N-[3-(2-oxopiperidin-1-yl)phenyl]pyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)C=CC(=O)NC2=CC3=C(CCCN3S(=O)(=O)C4=CC=C(C=C4)F)C=C2

DOS

IR

Vibrations