Geometry & MOs

Info

ID:	341413
PubChem CID:	127264106
Reduced:	OC15H20 (1)
Stoich.:	AB15C20 (1)
Weight, g/mol:	302.151809
ΔH_f, kcal/mol:	-53.28
Dipole, Da:	3.92
IP(EA), eV:	-9.35(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-(2-methylpropyl)-5-oxo-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl]-2-oxoacetate

Drug info:

PubChemData

Smile

CC(C)CC1=CC2=C(C=C1)C(=O)CCCC2

DOS

IR

Vibrations