Geometry & MOs

Info

ID:	170390
PubChem CID:	75226578
Reduced:	O7C32H38 (1)
Stoich.:	A7B32C38 (1)
Weight, g/mol:	551.309432
ΔH_f, kcal/mol:	-212.26
Dipole, Da:	2.88
IP(EA), eV:	-8.27(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

16-[1-(carboxymethyl)-5-oxo-2H-pyrrol-4-yl]-3-ethoxycarbonyl-2,3-dihydroxy-2,5,9,13-tetramethylhexadeca-9,13-dienoic acid

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C=C2CCCC(=CC3=CC(=C(C=C3)OC4CCCOC4)OC)C2=O)OC5CCCOC5

DOS

IR

Vibrations