Geometry & MOs

Info

ID:	391252
PubChem CID:	135003893
Reduced:	OS2C25H50 (1)
Stoich.:	AB2C25D50 (1)
Weight, g/mol:	272.235145
ΔH_f, kcal/mol:	-161.0
Dipole, Da:	0.64
IP(EA), eV:	-8.94(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(6S,8R)-6-hydroxypentadecan-8-yl] formate

Drug info:

PubChemData

Smile

CCCCCC(C)(CCCC)SC(=O)SC(CCCC)(CCCC)CCCC

DOS

IR

Vibrations