Geometry & MOs

Info

ID:	267827
PubChem CID:	103589704
Reduced:	BrSO3N5H10C11 (1)
Stoich.:	ABC3D5E10F11 (1)
Weight, g/mol:	355.98687
ΔH_f, kcal/mol:	49.31
Dipole, Da:	4.89
IP(EA), eV:	-9.18(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3-bromo-5-nitrophenoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine

Drug info:

PubChemData

Smile

CSC1=NC(=CC(=N1)OC2=CC(=CC(=C2)[N+](=O)[O-])Br)NN

DOS

IR

Vibrations