Geometry & MOs

Info

ID:	269211
PubChem CID:	103616366
Reduced:	FNOC18H28 (1)
Stoich.:	ABCD18E28 (1)
Weight, g/mol:	295.231143
ΔH_f, kcal/mol:	-85.4
Dipole, Da:	3.2
IP(EA), eV:	-8.78(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(2-ethylhexoxy)-5-fluorophenyl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CCCCC(CC)COC1=C(C=C(C=C1)F)CNC2CC2

DOS

IR

Vibrations