Geometry & MOs

Info

ID:	342067
PubChem CID:	127264780
Reduced:	OF3N3H10C14 (1)
Stoich.:	AB3C3D10E14 (1)
Weight, g/mol:	283.057947
ΔH_f, kcal/mol:	-113.51
Dipole, Da:	3.91
IP(EA), eV:	-9.54(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-4-(2-pyrimidin-4-ylethenyl)-1,3-thiazole

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NC(=O)C(F)(F)F)C=CC2=NC=NC=C2

DOS

IR

Vibrations