Geometry & MOs

Info

ID:	191054
PubChem CID:	78099877
Reduced:	O3C9H17 (2)
Stoich.:	A3B9C17 (2)
Weight, g/mol:	360.251189
ΔH_f, kcal/mol:	-323.17
Dipole, Da:	8.82
IP(EA), eV:	-9.87(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-(3,5-dihydroxy-6-methyloxan-2-yl)oxytridecanoic acid

Drug info:

PubChemData

Smile

CC1C(CC(C(O1)OC(C)CCCCCCCCCC(=O)O)O)O

DOS

IR

Vibrations