Geometry & MOs

Info

ID:	269199
PubChem CID:	103616323
Reduced:	FNO2C15H20 (1)
Stoich.:	ABC2D15E20 (1)
Weight, g/mol:	293.215493
ΔH_f, kcal/mol:	-97.92
Dipole, Da:	2.92
IP(EA), eV:	-8.94(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(2-ethylcyclohexyl)oxy-5-fluorophenyl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

C1CC(OC1)COC2=C(C=C(C=C2)F)CNC3CC3

DOS

IR

Vibrations