Geometry & MOs

Info

ID:	375854
PubChem CID:	134221848
Reduced:	OCl3C6H7 (1)
Stoich.:	AB3C6D7 (1)
Weight, g/mol:	238.037227
ΔH_f, kcal/mol:	-56.54
Dipole, Da:	2.71
IP(EA), eV:	-9.64(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-2,5-dimethylphenyl)-2,2,2-trifluoroethanol

Drug info:

PubChemData

Smile

C=C/C(=C(\CC(O)Cl)/Cl)/Cl

DOS

IR

Vibrations