Geometry & MOs

Info

ID:	396544
PubChem CID:	135028716
Reduced:	SO2H14C15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	439.04192
ΔH_f, kcal/mol:	-42.52
Dipole, Da:	2.86
IP(EA), eV:	-8.67(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromophenyl)-(4-methylanilino)methyl]-6-methylfuro[3,2-c]pyran-3,4-dione

Drug info:

PubChemData

Smile

CC(=C1C(=O)C2=C([C@]1(C)O)C3=CC=CC=C3S2)C

DOS

IR

Vibrations