Geometry & MOs

Info

ID:	390585
PubChem CID:	134999830
Reduced:	NO2F3C11H12 (1)
Stoich.:	AB2C3D11E12 (1)
Weight, g/mol:	228.097329
ΔH_f, kcal/mol:	-237.41
Dipole, Da:	2.92
IP(EA), eV:	-10.37(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-1-[(2S,3R)-3-pentyloxiran-2-yl]ethane-1,1-diol

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)C(F)(F)F)NC(=O)OC

DOS

IR

Vibrations