Geometry & MOs

Info

ID:	194181
PubChem CID:	78495142
Reduced:	SO2N4H12C20 (1)
Stoich.:	AB2C4D12E20 (1)
Weight, g/mol:	406.113984
ΔH_f, kcal/mol:	154.8
Dipole, Da:	3.73
IP(EA), eV:	-9.06(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)-1-(4-phenylphenyl)prop-2-en-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(N3C=CSC3=N2)C=C(C#N)C4=CC=C(C=C4)[N+](=O)[O-]

DOS

IR

Vibrations