Geometry & MOs

Info

ID:	88091
PubChem CID:	49900796
Reduced:	NSO3H11C13 (2)
Stoich.:	ABC3D11E13 (2)
Weight, g/mol:	422.99286
ΔH_f, kcal/mol:	-171.09
Dipole, Da:	11.71
IP(EA), eV:	-9.15(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C(=O)/C(=C/C3=CC(=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)NC(=O)C)/SC2=O

DOS

IR

Vibrations