Geometry & MOs

Info

ID:	352933
PubChem CID:	127284023
Reduced:	SN2O3C19H26 (1)
Stoich.:	AB2C3D19E26 (1)
Weight, g/mol:	392.176979
ΔH_f, kcal/mol:	-106.35
Dipole, Da:	7.01
IP(EA), eV:	-9.59(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-(4-methylidenepiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(=C)CC3

DOS

IR

Vibrations