Geometry & MOs

Info

ID:	197960
PubChem CID:	79022085
Reduced:	ON2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	268.122321
ΔH_f, kcal/mol:	-35.75
Dipole, Da:	5.13
IP(EA), eV:	-8.75(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-fluoro-4-nitrophenyl)methoxymethyl]piperidine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)N2CCCNC2=O

DOS

IR

Vibrations