Geometry & MOs

Info

ID:	86546
PubChem CID:	49886940
Reduced:	NSO5H17C23 (1)
Stoich.:	ABC5D17E23 (1)
Weight, g/mol:	363.054084
ΔH_f, kcal/mol:	-113.91
Dipole, Da:	2.86
IP(EA), eV:	-9.26(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)O)C2=CC=C(O2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC=C4

DOS

IR

Vibrations