Geometry & MOs

Info

ID:	283580
PubChem CID:	103990327
Reduced:	SO2N4C11H16 (1)
Stoich.:	AB2C4D11E16 (1)
Weight, g/mol:	332.015304
ΔH_f, kcal/mol:	-33.6
Dipole, Da:	10.8
IP(EA), eV:	-9.54(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dichlorophenyl)sulfonyl-4-methylpiperidine-4-carbonitrile

Drug info:

PubChemData

Smile

CC1(CCN(CC1)S(=O)(=O)C2=CN(C=N2)C)C#N

DOS

IR

Vibrations