Geometry & MOs

Info

ID:	408763
PubChem CID:	135081531
Reduced:	NOC4H5 (2)
Stoich.:	ABC4D5 (2)
Weight, g/mol:	167.082053
ΔH_f, kcal/mol:	-13.42
Dipole, Da:	5.37
IP(EA), eV:	-9.43(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(1R,4R,6R)-3-hydroxy-6-methoxybicyclo[2.2.1]hept-2-ene-2-diazonium

Drug info:

PubChemData

Smile

CO[C@@H]1C[C@H]2C[C@@H]1C(=[N+]=[N-])C2=O

DOS

IR

Vibrations