Geometry & MOs

Info

ID:	56955
PubChem CID:	22395048
Reduced:	O3C16H32 (1)
Stoich.:	A3B16C32 (1)
Weight, g/mol:	146.094294
ΔH_f, kcal/mol:	-198.17
Dipole, Da:	2.66
IP(EA), eV:	-9.73(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(2-methylpropoxy)acetate

Drug info:

PubChemData

Smile

CCOCCCCCCCCCCCC(=O)OCC

DOS

IR

Vibrations