Geometry & MOs

Info

ID:	123687
PubChem CID:	50858666
Reduced:	SN2O3C27H32 (1)
Stoich.:	AB2C3D27E32 (1)
Weight, g/mol:	434.202799
ΔH_f, kcal/mol:	-98.05
Dipole, Da:	6.95
IP(EA), eV:	-8.07(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-3-[(4-methylphenyl)methyl]-5-[(1,2,2,4,7-pentamethyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)C)/C=C/3\C(=O)N(C(=O)S3)CCOC4=CC=C(C=C4)C)C)(C)C

DOS

IR

Vibrations