Geometry & MOs

Info

ID:	13877
PubChem CID:	399516
Reduced:	NOS2H13C21 (1)
Stoich.:	ABC2D13E21 (1)
Weight, g/mol:	359.043856
ΔH_f, kcal/mol:	80.06
Dipole, Da:	0.83
IP(EA), eV:	-8.11(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenoxathiin-2-yl-2-phenyl-1,3-thiazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=CS2)C3=CC4=C(C=C3)OC5=CC=CC=C5S4

DOS

IR

Vibrations