Geometry & MOs

Info

ID:	342779
PubChem CID:	127265942
Reduced:	SO5N6C25H26 (1)
Stoich.:	AB5C6D25E26 (1)
Weight, g/mol:	302.166414
ΔH_f, kcal/mol:	-89.18
Dipole, Da:	5.36
IP(EA), eV:	-8.57(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-bicyclo[2.2.2]octanylmethylsulfonylamino)-N-ethylpropanamide

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC(=O)NN/C=C\3/C=CC=CC3=O)CCC4=CC=C(C=C4)OC

DOS

IR

Vibrations