Geometry & MOs

Info

ID:	382746
PubChem CID:	134974072
Reduced:	NO3C6H13 (1)
Stoich.:	AB3C6D13 (1)
Weight, g/mol:	192.078644
ΔH_f, kcal/mol:	-148.88
Dipole, Da:	3.81
IP(EA), eV:	-9.63(1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,4E,6E,8E)-10-oxoundeca-2,4,6,8-tetraenoic acid

Drug info:

PubChemData

Smile

C[C@@H]1C(C(C(N1)CO)O)O

DOS

IR

Vibrations