Geometry & MOs

Info

ID:	161307
PubChem CID:	57391307
Reduced:	ClFON2C19H22 (1)
Stoich.:	ABCD2E19F22 (1)
Weight, g/mol:	256.047048
ΔH_f, kcal/mol:	-50.28
Dipole, Da:	3.3
IP(EA), eV:	-8.39(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-4-pyridin-3-yl-1,3-thiazole

Drug info:

PubChemData

Smile

C1CN(CCN1CCCOC2=CC=C(C=C2)F)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations