Geometry & MOs

Info

ID:	129422
PubChem CID:	51072535
Reduced:	SN2O3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	328.153541
ΔH_f, kcal/mol:	-87.61
Dipole, Da:	4.2
IP(EA), eV:	-9.5(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-oxo-1-phenyl-4,5-dihydropyridazine-3-carbonyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)C(=O)NC2CC2)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations