Geometry & MOs

Info

ID:	10825
PubChem CID:	108317
Reduced:	OC9H18 (2)
Stoich.:	AB9C18 (2)
Weight, g/mol:	284.27153
ΔH_f, kcal/mol:	-175.65
Dipole, Da:	2.11
IP(EA), eV:	-10.7(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexan-2-yl dodecanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)OC(C)CCCC

DOS

IR

Vibrations