Geometry & MOs

Info

ID:	342581
PubChem CID:	127265741
Reduced:	NOH7C8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	297.073597
ΔH_f, kcal/mol:	23.97
Dipole, Da:	1.31
IP(EA), eV:	-8.57(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-4-(2-pyrazin-2-ylprop-1-enyl)-1,3-thiazole

Drug info:

PubChemData

Smile

CC(=CC1=CC2=C(O1)C(=CC=C2)OC)C3=NC=CN=C3

DOS

IR

Vibrations