Geometry & MOs

Info

ID:	257901
PubChem CID:	103149125
Reduced:	NF2O2C12H17 (1)
Stoich.:	AB2C2D12E17 (1)
Weight, g/mol:	259.138385
ΔH_f, kcal/mol:	-168.76
Dipole, Da:	4.91
IP(EA), eV:	-8.86(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-1-(2-methoxy-5-methylphenyl)propan-1-amine

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C(CCOCC(F)F)N

DOS

IR

Vibrations