Geometry & MOs

Info

ID:

87906

PubChem CID:

49898536

Reduced:

SO2N3H9C14 (2)

Stoich.:

AB2C3D9E14 (2)

Weight, g/mol:

432.150764

ΔHf, kcal/mol:

117.3

Dipole, Da:

5.39

IP(EA), eV:

 -9.0(-2.03)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C=C(C=C3)/C=C\4/C(=O)N(C(=O)S4)CC5=CC=CC6=CC=CC=C65)[N+](=O)[O-]

DOS

IR

Vibrations