Geometry & MOs

Info

ID:	340811
PubChem CID:	127263246
Reduced:	NO3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	211.120843
ΔH_f, kcal/mol:	-156.07
Dipole, Da:	2.09
IP(EA), eV:	-9.45(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1R,2R,5S)-8-methyl-3-oxo-8-azabicyclo[3.2.1]octane-2-carboxylate

Drug info:

PubChemData

Smile

CC(=C)CC1C(=O)CCCN1C(=O)OC(C)(C)C

DOS

IR

Vibrations