Geometry & MOs

Info

ID:	413370
PubChem CID:	135086319
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	352.113316
ΔH_f, kcal/mol:	-159.72
Dipole, Da:	1.06
IP(EA), eV:	-9.62(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-2-(2-methoxyphenyl)-3-[(S)-(4-methylphenyl)sulfinyl]benzene

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)C(=C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations