Geometry & MOs

Info

ID:	394173
PubChem CID:	135022473
Reduced:	ON2H14C18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	367.087829
ΔH_f, kcal/mol:	37.15
Dipole, Da:	7.71
IP(EA), eV:	-9.06(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-methylphenyl)sulfonyl-2-pyridin-2-ylphenyl] acetate

Drug info:

PubChemData

Smile

C1CC2=C(C3=CC=CC=C31)NC(=NC2=O)C4=CC=CC=C4

DOS

IR

Vibrations