Geometry & MOs

Info

ID:	297094
PubChem CID:	117608522
Reduced:	SO3N4C22H24 (1)
Stoich.:	AB3C4D22E24 (1)
Weight, g/mol:	474.188983
ΔH_f, kcal/mol:	193.58
Dipole, Da:	3.81
IP(EA), eV:	-7.87(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-prop-2-enoyloxy-2,2-bis(prop-2-enoyloxymethyl)propyl] (5Z,7Z)-3-hydroxy-2,4-dimethylidenenona-5,7-dienoate

Drug info:

PubChemData

Smile

C1CC1C2=CN3C(=NN=C3NS(=O)(=O)C4CC4)C=C2OCCC5=C6C7CC6C7=CC5

DOS

IR

Vibrations