Geometry & MOs

Info

ID:	341092
PubChem CID:	127263527
Reduced:	ClNO2C6H14 (1)
Stoich.:	ABC2D6E14 (1)
Weight, g/mol:	244.142307
ΔH_f, kcal/mol:	-133.67
Dipole, Da:	2.01
IP(EA), eV:	-9.6(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aR,8aR)-5-methyl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;oxalic acid

Drug info:

PubChemData

Smile

CO[C@@H]1COCC[C@@H]1N.Cl

DOS

IR

Vibrations