Geometry & MOs

Info

ID:	441708
PubChem CID:	135241576
Reduced:	BrON3C8H12 (1)
Stoich.:	ABC3D8E12 (1)
Weight, g/mol:	350.975533
ΔH_f, kcal/mol:	17.98
Dipole, Da:	5.7
IP(EA), eV:	-8.98(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-(2,3,4,5,6-pentafluorophenyl)sulfonylamino]propanoyl chloride

Drug info:

PubChemData

Smile

CN(C)C1CN2C(=C(C=N2)Br)OC1

DOS

IR

Vibrations