Geometry & MOs

Info

ID:	387338
PubChem CID:	134984987
Reduced:	N2O2H22C23 (1)
Stoich.:	A2B2C22D23 (1)
Weight, g/mol:	452.18035
ΔH_f, kcal/mol:	27.1
Dipole, Da:	3.4
IP(EA), eV:	-9.09(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2R,4R)-1-(diethylsulfamoyl)-7,7-dimethyl-2-bicyclo[2.2.1]heptanyl] (2R)-2-phenylsulfanylaziridine-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1[C@@H](N1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=N4

DOS

IR

Vibrations