Geometry & MOs

Info

ID:	244095
PubChem CID:	99313642
Reduced:	SO2N5C21H21 (1)
Stoich.:	AB2C5D21E21 (1)
Weight, g/mol:	361.123798
ΔH_f, kcal/mol:	6.0
Dipole, Da:	2.82
IP(EA), eV:	-8.84(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-difluorobenzoyl)-N-(2-oxo-1H-pyridin-3-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(S1)C)C2=NC3=C(C=NN3C(C)C)C(=C2)C(=O)NC4=CC=CNC4=O

DOS

IR

Vibrations