Geometry & MOs

Info

ID:	13421
PubChem CID:	231272
Reduced:	N3O7C11H13 (1)
Stoich.:	A3B7C11D13 (1)
Weight, g/mol:	299.07535
ΔH_f, kcal/mol:	-115.59
Dipole, Da:	5.74
IP(EA), eV:	-10.23(-2.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(2-hydroxyethyl)-3,5-dinitrobenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations