Geometry & MOs

Info

ID:	171252
PubChem CID:	75349887
Reduced:	NSO6H23C30 (1)
Stoich.:	ABC6D23E30 (1)
Weight, g/mol:	543.110021
ΔH_f, kcal/mol:	-119.71
Dipole, Da:	2.47
IP(EA), eV:	-8.88(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[3-methoxy-4-(5-nitropyridin-2-yl)oxyphenyl]methylidene]-3-(2-naphthalen-1-yloxyethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CCOC3=CC=CC4=CC=CC=C43)OC(=O)C5=CC=CC=C5

DOS

IR

Vibrations