Geometry & MOs

Info

ID:	341307
PubChem CID:	127264000
Reduced:	NO4C14H17 (1)
Stoich.:	AB4C14D17 (1)
Weight, g/mol:	288.136159
ΔH_f, kcal/mol:	-113.85
Dipole, Da:	3.34
IP(EA), eV:	-9.57(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[6-(2-methylpropyl)-1-oxo-3,4-dihydro-2H-naphthalen-2-yl]-2-oxoacetate

Drug info:

PubChemData

Smile

COC(=O)C1CN(CCC1=O)OCC2=CC=CC=C2

DOS

IR

Vibrations