Geometry & MOs

Info

ID:	172872
PubChem CID:	75563149
Reduced:	ClN3O4C26H28 (1)
Stoich.:	AB3C4D26E28 (1)
Weight, g/mol:	449.213698
ΔH_f, kcal/mol:	-143.89
Dipole, Da:	14.51
IP(EA), eV:	-8.55(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1-ethyl-7-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-6-yl)methylidene]-3-methyl-2-phenylimino-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)OC)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Cl)C(CC1(C)C)C

DOS

IR

Vibrations