Geometry & MOs

Info

ID:	50391
PubChem CID:	12012919
Reduced:	NO2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	296.188863
ΔH_f, kcal/mol:	-116.49
Dipole, Da:	5.07
IP(EA), eV:	-9.39(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-9-benzylimino-4-methyl-2-prop-2-enyl-2-azaspiro[4.4]nonan-1-one

Drug info:

PubChemData

Smile

C[C@@H]1CCN(C(=O)[C@]12CC(CC2=O)(C)C)C

DOS

IR

Vibrations