Geometry & MOs

Info

ID:	267764
PubChem CID:	103588710
Reduced:	BrN3O4H10C13 (1)
Stoich.:	AB3C4D10E13 (1)
Weight, g/mol:	317.00112
ΔH_f, kcal/mol:	18.25
Dipole, Da:	5.08
IP(EA), eV:	-9.26(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-bromo-5-nitrophenoxy)-N'-hydroxybutanimidamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C(=N\O)/N)OC2=CC(=CC(=C2)[N+](=O)[O-])Br

DOS

IR

Vibrations