Geometry & MOs

Info

ID:	260514
PubChem CID:	103194230
Reduced:	SN3O3C14H21 (1)
Stoich.:	AB3C3D14E21 (1)
Weight, g/mol:	331.07574
ΔH_f, kcal/mol:	-119.45
Dipole, Da:	3.01
IP(EA), eV:	-8.81(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-4-chlorophenyl)sulfonyl-N-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC)N

DOS

IR

Vibrations