Geometry & MOs

Info

ID:	311514
PubChem CID:	126592987
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	434.04235
ΔH_f, kcal/mol:	-166.49
Dipole, Da:	2.47
IP(EA), eV:	-9.6(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3-bromo-4-fluorophenyl)-2-[(2S,6R)-2,6-dimethyl-1-sulfamoylpiperidin-4-yl]-2-oxoethanimidamide

Drug info:

PubChemData

Smile

C[C@@H]1CC(C[C@@H](N1C(=O)OC(C)(C)C)C)C=O

DOS

IR

Vibrations