Geometry & MOs

Info

ID:	403282
PubChem CID:	135059543
Reduced:	SO3C16H16 (1)
Stoich.:	AB3C16D16 (1)
Weight, g/mol:	292.040545
ΔH_f, kcal/mol:	-91.88
Dipole, Da:	6.09
IP(EA), eV:	-9.14(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethoxybenzo[c][1,2]benzoxathiine 6,6-dioxide

Drug info:

PubChemData

Smile

CC1=C2C3=CC=CC=C3S(=O)(=O)OC2=C(C=C1)C(C)C

DOS

IR

Vibrations