Geometry & MOs

Info

ID:	371385
PubChem CID:	127346101
Reduced:	N3O3C16H17 (1)
Stoich.:	A3B3C16D17 (1)
Weight, g/mol:	269.116427
ΔH_f, kcal/mol:	-86.64
Dipole, Da:	7.65
IP(EA), eV:	-9.6(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(11-azatricyclo[6.2.1.02,7]undeca-2,4,6-trien-11-yl)-2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone

Drug info:

PubChemData

Smile

C1CC2C3=CC=CC=C3C1N2C(=O)CN4CCC(=O)NC4=O

DOS

IR

Vibrations