Geometry & MOs

Info

ID:	50654
PubChem CID:	12013221
Reduced:	O5C27H52 (1)
Stoich.:	A5B27C52 (1)
Weight, g/mol:	504.41786
ΔH_f, kcal/mol:	-328.59
Dipole, Da:	5.24
IP(EA), eV:	-10.43(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-dodecoxy-3-phenylmethoxypropan-2-yl] decanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCOC[C@@H](CCC(=O)O)OC(=O)CCCCCCCCC

DOS

IR

Vibrations