Geometry & MOs

Info

ID:	413460
PubChem CID:	135086409
Reduced:	SO4C16H16 (1)
Stoich.:	AB4C16D16 (1)
Weight, g/mol:	324.082016
ΔH_f, kcal/mol:	-108.98
Dipole, Da:	5.01
IP(EA), eV:	-8.85(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylphenyl)sulfonyl-2-naphthalen-1-ylacetaldehyde

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)C(C=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations