Geometry & MOs

Info

ID:	265323
PubChem CID:	103517194
Reduced:	OF2N3C12H21 (1)
Stoich.:	AB2C3D12E21 (1)
Weight, g/mol:	241.164206
ΔH_f, kcal/mol:	-120.47
Dipole, Da:	1.79
IP(EA), eV:	-8.71(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2,2-difluoro-1-(3-propylphenyl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(C1=C(C=NN1CCC)OC)C(F)F

DOS

IR

Vibrations