Geometry & MOs

Info

ID:	401001
PubChem CID:	135049726
Reduced:	ON2H6C10 (1)
Stoich.:	AB2C6D10 (1)
Weight, g/mol:	230.050569
ΔH_f, kcal/mol:	59.41
Dipole, Da:	4.47
IP(EA), eV:	-9.11(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC(=[13C]2[N+]#N)[O-]

DOS

IR

Vibrations