Geometry & MOs

Info

ID:	273701
PubChem CID:	103771837
Reduced:	N2O5C13H18 (1)
Stoich.:	A2B5C13D18 (1)
Weight, g/mol:	280.105922
ΔH_f, kcal/mol:	-118.04
Dipole, Da:	8.62
IP(EA), eV:	-9.75(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[2-(2-methylprop-2-enoxy)ethyl]-4-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C1=CC(=C(C=C1)[N+](=O)[O-])O

DOS

IR

Vibrations