Geometry & MOs

Info

ID:	249288
PubChem CID:	103088333
Reduced:	BrFSCl2N2O2H6C11 (1)
Stoich.:	ABCD2E2F2G6H11 (1)
Weight, g/mol:	192.093249
ΔH_f, kcal/mol:	-73.41
Dipole, Da:	3.88
IP(EA), eV:	-9.67(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylsulfanylbutylamino)oxyacetamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1S(=O)(=O)NC2=NC=CC(=C2)Br)Cl)F)Cl

DOS

IR

Vibrations