Geometry & MOs

Info

ID:	128637
PubChem CID:	51052828
Reduced:	SO3N4C19H20 (1)
Stoich.:	AB3C4D19E20 (1)
Weight, g/mol:	420.075548
ΔH_f, kcal/mol:	-15.12
Dipole, Da:	2.42
IP(EA), eV:	-8.68(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[3-(difluoromethoxy)phenyl]-4-(3-fluorophenyl)-3-methyl-6,7-dihydro-[1,3]thiazolo[4,5-b]pyridine-2,5-dione

Drug info:

PubChemData

Smile

CC(C)C1=NN=C(S1)NC(=O)C2=CC(=O)C(=CN2C)OCC3=CC=CC=C3

DOS

IR

Vibrations