Geometry & MOs

Info

ID:	314198
PubChem CID:	126620878
Reduced:	SO2N4C15H18 (1)
Stoich.:	AB2C4D15E18 (1)
Weight, g/mol:	481.265065
ΔH_f, kcal/mol:	-1.32
Dipole, Da:	10.92
IP(EA), eV:	-8.53(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1Z)-buta-1,3-dienyl]-1-cycloundecylsulfonyl-5-ethenyl-3-[(3E,5Z)-octa-1,3,5,7-tetraen-4-yl]-3H-pyrrol-2-one

Drug info:

PubChemData

Smile

CN(CCC=C)C1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)O

DOS

IR

Vibrations