Geometry & MOs

Info

ID:	263434
PubChem CID:	103366726
Reduced:	NO2F3C13H18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	227.113313
ΔH_f, kcal/mol:	-221.6
Dipole, Da:	1.28
IP(EA), eV:	-8.48(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-2-(oxan-4-yloxymethyl)propan-1-amine

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)OCC(CN)C(F)(F)F

DOS

IR

Vibrations