Geometry & MOs

Info

ID:	50653
PubChem CID:	12013220
Reduced:	O4C27H52 (1)
Stoich.:	A4B27C52 (1)
Weight, g/mol:	456.381475
ΔH_f, kcal/mol:	-270.1
Dipole, Da:	1.07
IP(EA), eV:	-9.91(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-decanoyloxy-5-dodecoxypentanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations