Geometry & MOs

Info

ID:	198927
PubChem CID:	79173083
Reduced:	NOCl2C11H11 (1)
Stoich.:	ABC2D11E11 (1)
Weight, g/mol:	265.251798
ΔH_f, kcal/mol:	5.96
Dipole, Da:	3.94
IP(EA), eV:	-9.32(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-methyl-1-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)cyclohexyl]methanamine

Drug info:

PubChemData

Smile

C1CC1C(=O)C2=CN(C=C2)CC(=CCl)Cl

DOS

IR

Vibrations