Geometry & MOs

Info

ID:	51940
PubChem CID:	12014710
Reduced:	SO4H20C23 (1)
Stoich.:	AB4C20D23 (1)
Weight, g/mol:	376.113316
ΔH_f, kcal/mol:	-70.92
Dipole, Da:	5.65
IP(EA), eV:	-9.14(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-1-phenylprop-2-en-1-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)/C(=C\C2=CC=C(C=C2)OC)/C(=O)C3=CC=CC=C3

DOS

IR

Vibrations