Geometry & MOs

Info

ID:	383272
PubChem CID:	134974900
Reduced:	N2C19H22 (1)
Stoich.:	A2B19C22 (1)
Weight, g/mol:	374.293328
ΔH_f, kcal/mol:	48.69
Dipole, Da:	3.07
IP(EA), eV:	-8.72(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(5S)-7-(5-phenylmethoxypentyl)-3,7-diazabicyclo[3.3.1]nonan-3-yl]butan-2-ol

Drug info:

PubChemData

Smile

C1[C@H]2CNC(C1CN[C@H]2C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations