Geometry & MOs

Info

ID:	201995
PubChem CID:	79615146
Reduced:	N4C15H20 (1)
Stoich.:	A4B15C20 (1)
Weight, g/mol:	234.173213
ΔH_f, kcal/mol:	45.52
Dipole, Da:	5.96
IP(EA), eV:	-9.17(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-methylbut-3-yn-2-yl)acetamide

Drug info:

PubChemData

Smile

CN1C2=C(C=NC=C2)N=C1CC3CC4CCC(C3)N4

DOS

IR

Vibrations