Geometry & MOs

Info

ID:	153293
PubChem CID:	56312471
Reduced:	FO3N5C24H24 (1)
Stoich.:	AB3C5D24E24 (1)
Weight, g/mol:	389.086784
ΔH_f, kcal/mol:	-53.58
Dipole, Da:	6.02
IP(EA), eV:	-8.94(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyanopiperidine-1-carbonyl)-N-(4-methylphenyl)thiophene-3-sulfonamide

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)CN2C=C(C=N2)NC(=O)/C=C/C3=CC(=C(C=C3)OC4=CN=CC=C4)F

DOS

IR

Vibrations