Geometry & MOs

Info

ID:	358750
PubChem CID:	127296564
Reduced:	SN2O2C10H18 (1)
Stoich.:	AB2C2D10E18 (1)
Weight, g/mol:	395.176644
ΔH_f, kcal/mol:	-80.61
Dipole, Da:	3.13
IP(EA), eV:	-9.45(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-5-ylsulfonyl)-4-(4-methylcyclohexyl)oxypiperidine

Drug info:

PubChemData

Smile

C=C1CCN(CC1)S(=O)(=O)N2CCCC2

DOS

IR

Vibrations