Geometry & MOs

Info

ID:	358767
PubChem CID:	127296633
Reduced:	O3N5C15H19 (1)
Stoich.:	A3B5C15D19 (1)
Weight, g/mol:	382.111791
ΔH_f, kcal/mol:	-81.97
Dipole, Da:	5.32
IP(EA), eV:	-9.09(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)N3CCC(=C)CC3

DOS

IR

Vibrations