Geometry & MOs

Info

ID:	9882
PubChem CID:	94380
Reduced:	O4C15H32 (1)
Stoich.:	A4B15C32 (1)
Weight, g/mol:	276.23006
ΔH_f, kcal/mol:	-246.78
Dipole, Da:	4.3
IP(EA), eV:	-10.32(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dodecanoic acid;propane-1,2-diol

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)O.CC(CO)O

DOS

IR

Vibrations