Geometry & MOs

Info

ID:	289801
PubChem CID:	104373769
Reduced:	BrON2F3C10H14 (1)
Stoich.:	ABC2D3E10F14 (1)
Weight, g/mol:	267.97106
ΔH_f, kcal/mol:	-188.78
Dipole, Da:	2.73
IP(EA), eV:	-9.32(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-(3-bromophenyl)-1,1,1-trifluoropropan-2-ol

Drug info:

PubChemData

Smile

CCC1=NN(C(=C1Br)C[C@@H](C(F)(F)F)O)CC

DOS

IR

Vibrations