Geometry & MOs

Info

ID:	424258
PubChem CID:	135121951
Reduced:	N3O4C11H14 (2)
Stoich.:	A3B4C11D14 (2)
Weight, g/mol:	229.095023
ΔH_f, kcal/mol:	-293.32
Dipole, Da:	7.97
IP(EA), eV:	-8.81(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-8-azabicyclo[3.2.1]octan-6-one;oxalic acid

Drug info:

PubChemData

Smile

C[C@@H]1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC(N)OC(=O)CC(CC(=O)[O-])(C(=O)[O-])O

DOS

IR

Vibrations