Geometry & MOs

Info

ID:	13240
PubChem CID:	223970
Reduced:	N2O5C6H9 (2)
Stoich.:	A2B5C6D9 (2)
Weight, g/mol:	378.102293
ΔH_f, kcal/mol:	-170.3
Dipole, Da:	3.64
IP(EA), eV:	-9.9(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[bis(2-hydroxyethyl)amino]ethanol;2,4,6-trinitrophenol

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C(CO)N(CCO)CCO

DOS

IR

Vibrations