Geometry & MOs

Info

ID:	13543
PubChem CID:	243791
Reduced:	O5C12H22 (1)
Stoich.:	A5B12C22 (1)
Weight, g/mol:	246.146724
ΔH_f, kcal/mol:	-259.41
Dipole, Da:	1.98
IP(EA), eV:	-10.86(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(1-ethoxycarbonyloxyethyl)pentanoate

Drug info:

PubChemData

Smile

CCCC(C(C)OC(=O)OCC)C(=O)OCC

DOS

IR

Vibrations