Geometry & MOs

Info

ID:	359118
PubChem CID:	127297378
Reduced:	S2N3O3C17H27 (1)
Stoich.:	A2B3C3D17E27 (1)
Weight, g/mol:	276.220164
ΔH_f, kcal/mol:	-116.73
Dipole, Da:	2.98
IP(EA), eV:	-8.93(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-cyclohex-2-en-1-ylpiperidin-4-yl)-piperidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(S1)C)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3CCC3

DOS

IR

Vibrations