Geometry & MOs

Info

ID:	269204
PubChem CID:	103616340
Reduced:	FNOC16H24 (1)
Stoich.:	ABCD16E24 (1)
Weight, g/mol:	281.179107
ΔH_f, kcal/mol:	-95.49
Dipole, Da:	4.56
IP(EA), eV:	-8.65(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-fluoro-2-(oxan-2-ylmethoxy)phenyl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CCNCC1=C(C=CC(=C1)F)OC2CCC(CC2)C

DOS

IR

Vibrations