Geometry & MOs

Info

ID:	297334
PubChem CID:	117615235
Reduced:	N2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	345.258026
ΔH_f, kcal/mol:	18.96
Dipole, Da:	1.92
IP(EA), eV:	-8.69(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[1-[[(1S,5R)-6,6-dimethyl-3-bicyclo[3.1.1]heptanyl]methyl]piperidin-4-yl]-4-fluorobenzene-1,2-diamine

Drug info:

PubChemData

Smile

C1CN(CCC1N)CC2CC3CC2C=C3

DOS

IR

Vibrations