Geometry & MOs

Info

ID:	192239
PubChem CID:	78248184
Reduced:	N3O4C15H17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	431.106553
ΔH_f, kcal/mol:	-105.52
Dipole, Da:	5.63
IP(EA), eV:	-8.8(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

4-[[3-ethyl-5-[(2-methoxynaphthalen-1-yl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate

Drug info:

PubChemData

Smile

COC(=O)CC1CC(=O)C2C(N1)NN(C2=O)C3=CC=CC=C3

DOS

IR

Vibrations