Geometry & MOs

Info

ID:	283313
PubChem CID:	103973600
Reduced:	O5C10H18 (1)
Stoich.:	A5B10C18 (1)
Weight, g/mol:	232.131074
ΔH_f, kcal/mol:	-248.25
Dipole, Da:	5.01
IP(EA), eV:	-10.73(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxycarbonyl-4-[(2-methylpropan-2-yl)oxy]butanoic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(CCOC(C)C)C(=O)O

DOS

IR

Vibrations