Geometry & MOs

Info

ID:	57371
PubChem CID:	22395768
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	245.175284
ΔH_f, kcal/mol:	-112.07
Dipole, Da:	5.49
IP(EA), eV:	-9.8(0.77)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

undecanoic acid;acetate

Drug info:

PubChemData

Smile

CC(CC(C)C(=O)O)C1CCCC=C1

DOS

IR

Vibrations