Geometry & MOs

Info

ID:	389098
PubChem CID:	134991139
Reduced:	ClN3H4O5C6 (1)
Stoich.:	AB3C4D5E6 (1)
Weight, g/mol:	1022.263981
ΔH_f, kcal/mol:	27.27
Dipole, Da:	5.2
IP(EA), eV:	-10.63(-2.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chloro(hydrido)ruthenium;methylcyclohexane;triphenylphosphane

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1[N+](=O)[O-])ONCl)[N+](=O)[O-]

DOS

IR

Vibrations