Geometry & MOs

Info

ID:	22923
PubChem CID:	599928
Reduced:	O2C10H15 (2)
Stoich.:	A2B10C15 (2)
Weight, g/mol:	334.214409
ΔH_f, kcal/mol:	-207.33
Dipole, Da:	1.08
IP(EA), eV:	-8.89(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-methyl-2-[2-(2-methyl-5-propan-2-ylphenyl)ethyl]propanedioate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)(CCC1=C(C=CC(=C1)C(C)C)C)C(=O)OCC

DOS

IR

Vibrations