Geometry & MOs

Info

ID:	291524
PubChem CID:	113284767
Reduced:	FN2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	248.168877
ΔH_f, kcal/mol:	24.42
Dipole, Da:	1.01
IP(EA), eV:	-8.93(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-fluoro-2-methylphenyl)methyl]-3,9-diazabicyclo[4.2.1]nonane

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CN2CCC3CCC(C2)N3)F

DOS

IR

Vibrations