Geometry & MOs

Info

ID:	231889
PubChem CID:	87574856
Reduced:	NOC8H8 (2)
Stoich.:	ABC8D8 (2)
Weight, g/mol:	296.155849
ΔH_f, kcal/mol:	7.53
Dipole, Da:	6.44
IP(EA), eV:	-8.56(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NZ)-2-methyl-N-[(3-oxo-2-prop-2-enyl-2-azabicyclo[2.2.2]octan-1-yl)methylidene]propane-2-sulfinamide

Drug info:

PubChemData

Smile

CC=CC=CC1=NC(=O)C(=CC2=CC=C(C=C2)O)N1C

DOS

IR

Vibrations