Geometry & MOs

Info

ID:	224915
PubChem CID:	85706071
Reduced:	NO4H19C20 (1)
Stoich.:	AB4C19D20 (1)
Weight, g/mol:	242.151809
ΔH_f, kcal/mol:	-81.18
Dipole, Da:	4.44
IP(EA), eV:	-8.86(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 9,9-dimethoxynona-2,4-dienoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(CO)COC(=O)C=CC2=CC=C(C=C2)C=CC=O

DOS

IR

Vibrations