Geometry & MOs

Info

ID:	87896
PubChem CID:	49898474
Reduced:	SN2O4H26C31 (1)
Stoich.:	AB2C4D26E31 (1)
Weight, g/mol:	473.16608
ΔH_f, kcal/mol:	-70.5
Dipole, Da:	5.28
IP(EA), eV:	-8.87(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)COC2=CC=C(C=C2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC5=CC=CC=C54)C

DOS

IR

Vibrations