Geometry & MOs

Info

ID:	412535
PubChem CID:	135085430
Reduced:	ZnH2O2C16F34 (1)
Stoich.:	AB2C2D16E34 (1)
Weight, g/mol:	384.88059
ΔH_f, kcal/mol:	-1795.28
Dipole, Da:	3.18
IP(EA), eV:	-9.96(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-bromo-3-[(4-methylphenyl)sulfonylamino]propanoyl bromide

Drug info:

PubChemData

Smile

C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(O)(F)F)(F)F)(F)F)(F)F.C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(O)(F)F)(F)F)(F)F)(F)F.[Zn]

DOS

IR

Vibrations