Geometry & MOs

Info

ID:	270787
PubChem CID:	103638111
Reduced:	Cl2N2O3C12H14 (1)
Stoich.:	A2B2C3D12E14 (1)
Weight, g/mol:	230.178299
ΔH_f, kcal/mol:	-52.67
Dipole, Da:	5.4
IP(EA), eV:	-9.72(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclohexen-1-yl)-1-(2,6-dimethylpyridin-3-yl)-N-methylmethanamine

Drug info:

PubChemData

Smile

C1CC(CCC1N)OC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl

DOS

IR

Vibrations