Geometry & MOs

Info

ID:	19312
PubChem CID:	560962
Reduced:	NSO4C10H13 (1)
Stoich.:	ABC4D10E13 (1)
Weight, g/mol:	243.056529
ΔH_f, kcal/mol:	-143.81
Dipole, Da:	5.59
IP(EA), eV:	-9.97(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methylphenyl)sulfonyl-1,3,5-dioxazinane

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2COCOC2

DOS

IR

Vibrations