Geometry & MOs

Info

ID:	267766
PubChem CID:	103588722
Reduced:	BrN3O4C12H14 (1)
Stoich.:	AB3C4D12E14 (1)
Weight, g/mol:	335.9858
ΔH_f, kcal/mol:	-7.41
Dipole, Da:	4.22
IP(EA), eV:	-9.18(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-bromo-5-nitrophenoxy)pyridine-2-carboximidamide

Drug info:

PubChemData

Smile

C1CC1(C/C(=N\O)/N)COC2=CC(=CC(=C2)[N+](=O)[O-])Br

DOS

IR

Vibrations