Geometry & MOs

Info

ID:	283574
PubChem CID:	103990268
Reduced:	SO2N3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	294.103814
ΔH_f, kcal/mol:	-21.61
Dipole, Da:	3.15
IP(EA), eV:	-10.06(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxyphenyl)sulfonyl-4-methylpiperidine-4-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C#N)S(=O)(=O)N2CCC(CC2)(C)C#N

DOS

IR

Vibrations