Geometry & MOs

Info

ID:	378656
PubChem CID:	134224750
Reduced:	SN2O3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	425.187209
ΔH_f, kcal/mol:	-90.31
Dipole, Da:	6.33
IP(EA), eV:	-9.62(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-3-[4-[tert-butyl-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]phenyl]-2,2-dimethylcyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

C/C=C(\C=C/C(=C)[C@@H]1[C@H](C1(C)C)C(=O)N)/S(=O)(=O)N

DOS

IR

Vibrations