Geometry & MOs

Info

ID:	352546
PubChem CID:	127283634
Reduced:	SN2O3C21H28 (1)
Stoich.:	AB2C3D21E28 (1)
Weight, g/mol:	376.182064
ΔH_f, kcal/mol:	-114.08
Dipole, Da:	2.43
IP(EA), eV:	-9.32(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-(4-methylidenepiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

C=C1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations