Geometry & MOs

Info

ID:	150785
PubChem CID:	53790481
Reduced:	BrPSCl3O3C16H21 (1)
Stoich.:	ABCD3E3F16G21 (1)
Weight, g/mol:	406.156243
ΔH_f, kcal/mol:	-212.33
Dipole, Da:	3.89
IP(EA), eV:	-9.53(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-2-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfonyloctanamide

Drug info:

PubChemData

Smile

CC(C)COP(=S)(OCC1C(C1(Cl)Cl)(C)C)OC2=C(C=C(C=C2)Br)Cl

DOS

IR

Vibrations