Geometry & MOs

Info

ID:	6093
PubChem CID:	66958
Reduced:	OC6H12 (3)
Stoich.:	AB6C12 (3)
Weight, g/mol:	300.266445
ΔH_f, kcal/mol:	-203.09
Dipole, Da:	3.27
IP(EA), eV:	-9.91(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butoxyethyl dodecanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)OCCOCCCC

DOS

IR

Vibrations