Geometry & MOs

Info

ID:	258016
PubChem CID:	103149968
Reduced:	OF2N3C12H19 (1)
Stoich.:	AB2C3D12E19 (1)
Weight, g/mol:	305.160263
ΔH_f, kcal/mol:	-119.31
Dipole, Da:	3.42
IP(EA), eV:	-9.35(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-1-(5-fluoro-2-methoxyphenyl)-N-propylpropan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CCOCC(F)F)C1=NC=CN=C1

DOS

IR

Vibrations