Geometry & MOs

Info

ID:	87833
PubChem CID:	49897823
Reduced:	BrSN2O3H15C20 (1)
Stoich.:	ABC2D3E15F20 (1)
Weight, g/mol:	557.089286
ΔH_f, kcal/mol:	-40.11
Dipole, Da:	4.3
IP(EA), eV:	-8.87(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)CN2C(=O)/C(=C/C=C/C3=CC=C(C=C3)Br)/SC2=O

DOS

IR

Vibrations