Geometry & MOs

Info

ID:	255215
PubChem CID:	103130707
Reduced:	ON2F3C6H7 (1)
Stoich.:	AB2C3D6E7 (1)
Weight, g/mol:	180.051047
ΔH_f, kcal/mol:	-166.36
Dipole, Da:	6.17
IP(EA), eV:	-10.04(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-2,2,2-trifluoro-1-(1-methylpyrazol-3-yl)ethanol

Drug info:

PubChemData

Smile

CN1C=CC(=N1)[C@@H](C(F)(F)F)O

DOS

IR

Vibrations