Geometry & MOs

Info

ID:	172851
PubChem CID:	75560709
Reduced:	ClO2N3C23H28 (1)
Stoich.:	AB2C3D23E28 (1)
Weight, g/mol:	518.271548
ΔH_f, kcal/mol:	-41.84
Dipole, Da:	8.27
IP(EA), eV:	-7.97(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-2-(4-morpholin-4-ylphenyl)imino-5-[(1,2,2,4,7-pentamethyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)C)C=NNC(=O)COC3=CC(=CC=C3)Cl)C)(C)C

DOS

IR

Vibrations