Geometry & MOs

Info

ID:	289803
PubChem CID:	104373784
Reduced:	OF3C10H11 (1)
Stoich.:	AB3C10D11 (1)
Weight, g/mol:	194.066697
ΔH_f, kcal/mol:	-202.06
Dipole, Da:	4.68
IP(EA), eV:	-9.56(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1,1,1-trifluoro-3-(1-methylpyrazol-3-yl)propan-2-ol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)[C@@H](C(F)(F)F)O)C

DOS

IR

Vibrations