Geometry & MOs

Info

ID:	284363
PubChem CID:	104045849
Reduced:	ClOSN2C12H19 (1)
Stoich.:	ABCD2E12F19 (1)
Weight, g/mol:	285.039041
ΔH_f, kcal/mol:	-38.36
Dipole, Da:	3.19
IP(EA), eV:	-8.87(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-chloropropyl)-2-(2-fluoro-6-methoxyphenyl)-1,3-thiazole

Drug info:

PubChemData

Smile

CCN1CCOC(C1)C2=NC(=CS2)CCCCl

DOS

IR

Vibrations