Geometry & MOs

Info

ID:	145203
PubChem CID:	53477480
Reduced:	O5C20H34 (1)
Stoich.:	A5B20C34 (1)
Weight, g/mol:	354.240624
ΔH_f, kcal/mol:	-256.82
Dipole, Da:	6.36
IP(EA), eV:	-9.68(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z,8R,9E)-10-[(1R,2R,3S,5R)-3,5-dihydroxy-2-pentylcyclopentyl]-8-hydroxydeca-5,9-dienoic acid

Drug info:

PubChemData

Smile

CCCCC/C=C\C[C@@H]1[C@@H](C[C@@H]([C@H]1/C=C/[C@H](CCCC(=O)O)O)O)O

DOS

IR

Vibrations