Geometry & MOs

Info

ID:	171079
PubChem CID:	75324010
Reduced:	BrSN2O5H21C23 (1)
Stoich.:	ABC2D5E21F23 (1)
Weight, g/mol:	490.03902
ΔH_f, kcal/mol:	-131.03
Dipole, Da:	3.42
IP(EA), eV:	-9.41(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene]-3-(naphthalen-2-ylmethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1COCCN1C(=O)CN2C(=O)C(=CC3=CC(=CC=C3)OCC4=CC=C(C=C4)Br)SC2=O

DOS

IR

Vibrations