Geometry & MOs

Info

ID:	224541
PubChem CID:	85344638
Reduced:	N2O2C11H12 (1)
Stoich.:	A2B2C11D12 (1)
Weight, g/mol:	205.097703
ΔH_f, kcal/mol:	57.44
Dipole, Da:	3.44
IP(EA), eV:	-9.65(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-hydroxy-1-(6-methylhepta-2,4-diynoxy)prop-1-ene-2-diazonium

Drug info:

PubChemData

Smile

CC(C)C#CC#CCOC(=O)C(=[N+]=[N-])C

DOS

IR

Vibrations