Geometry & MOs

Info

ID:	13876
PubChem CID:	399515
Reduced:	NOS2H15C23 (1)
Stoich.:	ABC2D15E23 (1)
Weight, g/mol:	385.059506
ΔH_f, kcal/mol:	92.28
Dipole, Da:	0.95
IP(EA), eV:	-8.1(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenoxathiin-2-yl-2-(2-phenylethenyl)-1,3-thiazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CC2=NC(=CS2)C3=CC4=C(C=C3)OC5=CC=CC=C5S4

DOS

IR

Vibrations