Geometry & MOs

Info

ID:	10848
PubChem CID:	108514
Reduced:	O2C7H13 (2)
Stoich.:	A2B7C13 (2)
Weight, g/mol:	258.183109
ΔH_f, kcal/mol:	-214.45
Dipole, Da:	3.23
IP(EA), eV:	-10.73(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-O-(3,7-dimethyloctyl) 1-O-ethyl oxalate

Drug info:

PubChemData

Smile

CCOC(=O)C(=O)OCCC(C)CCCC(C)C

DOS

IR

Vibrations