Geometry & MOs

Info

ID:	54846
PubChem CID:	17389392
Reduced:	BrNS2O3H12C14 (1)
Stoich.:	ABC2D3E12F14 (1)
Weight, g/mol:	281.94015
ΔH_f, kcal/mol:	-55.31
Dipole, Da:	1.62
IP(EA), eV:	-9.43(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-(4-aminooxybutyl)hydroxylamine;dihydrobromide

Drug info:

PubChemData

Smile

CCOC(=O)CSC1=NC(=O)/C(=C/C2=CC(=CC=C2)Br)/S1

DOS

IR

Vibrations