Geometry & MOs

Info

ID:	164434
PubChem CID:	74399798
Reduced:	N2O2C3H4 (4)
Stoich.:	A2B2C3D4 (4)
Weight, g/mol:	458.150974
ΔH_f, kcal/mol:	75.78
Dipole, Da:	7.02
IP(EA), eV:	-10.33(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethylamino-[5-[[[2-(hydroxymethyl)pyrrolidin-1-yl]-oxidoazaniumylidene]amino]oxy-2,4-dinitrophenoxy]imino-oxidoazanium

Drug info:

PubChemData

Smile

CN(C)[N+](=NOC1=C(C=C(C(=C1)ON=[N+](N2CCCC2)[O-])[N+](=O)[O-])[N+](=O)[O-])[O-]

DOS

IR

Vibrations