Geometry & MOs

Info

ID:	257893
PubChem CID:	103149083
Reduced:	NO2F3C12H16 (1)
Stoich.:	AB2C3D12E16 (1)
Weight, g/mol:	243.143471
ΔH_f, kcal/mol:	-210.48
Dipole, Da:	3.73
IP(EA), eV:	-8.79(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-1-(2,4-dimethylphenyl)propan-1-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations