Geometry & MOs

Info

ID:	205066
PubChem CID:	80050500
Reduced:	FNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	223.137242
ΔH_f, kcal/mol:	-133.49
Dipole, Da:	3.11
IP(EA), eV:	-8.96(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[5-fluoro-2-(3-methylbut-2-enoxy)phenyl]ethanamine

Drug info:

PubChemData

Smile

C[C@@H](C1=C(C=CC(=C1)F)OCC2(CCCC2)O)N

DOS

IR

Vibrations