Geometry & MOs

Info

ID:	86988
PubChem CID:	49890372
Reduced:	NSO3H13C16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	388.97213
ΔH_f, kcal/mol:	-70.09
Dipole, Da:	5.26
IP(EA), eV:	-8.87(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[2-[(4-bromophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1=C(C2=CC=CC=C2C=C1)/C=C\3/C(=O)NC(=O)S3

DOS

IR

Vibrations