Geometry & MOs

Info

ID:	373502
PubChem CID:	131316221
Reduced:	BrFOSH10C11 (1)
Stoich.:	ABCDE10F11 (1)
Weight, g/mol:	282.96665
ΔH_f, kcal/mol:	-52.12
Dipole, Da:	1.77
IP(EA), eV:	-8.44(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-bromo-3-methylphenyl)-1,3-thiazol-5-yl]methanol

Drug info:

PubChemData

Smile

CCOC1=C(SC2=CC=CC(=C21)CBr)F

DOS

IR

Vibrations