Geometry & MOs

Info

ID:	343366
PubChem CID:	127266539
Reduced:	NO3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	334.171499
ΔH_f, kcal/mol:	-139.75
Dipole, Da:	2.17
IP(EA), eV:	-9.25(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(3-phenylprop-2-enyl)piperidin-4-yl]-1,4-thiazinane 1,1-dioxide

Drug info:

PubChemData

Smile

CCC=CCCN1CC(CC1C(=O)OC)O

DOS

IR

Vibrations