Geometry & MOs

Info

ID:	283457
PubChem CID:	103983321
Reduced:	ON3C17H27 (1)
Stoich.:	AB3C17D27 (1)
Weight, g/mol:	251.168543
ΔH_f, kcal/mol:	-30.76
Dipole, Da:	3.91
IP(EA), eV:	-8.58(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-N-[2-(oxan-2-yl)ethyl]ethanamine

Drug info:

PubChemData

Smile

CCCN(CC(=O)N(C)C)C1CCNCC2=CC=CC=C12

DOS

IR

Vibrations