Geometry & MOs

Info

ID:	6976
PubChem CID:	70854
Reduced:	N3O4H9C12 (1)
Stoich.:	A3B4C9D12 (1)
Weight, g/mol:	259.059306
ΔH_f, kcal/mol:	44.1
Dipole, Da:	6.92
IP(EA), eV:	-10.31(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,4-dinitrophenyl)methyl]pyridine

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations