Geometry & MOs

Info

ID:	303612
PubChem CID:	124489960
Reduced:	F2O5C20H32 (1)
Stoich.:	A2B5C20D32 (1)
Weight, g/mol:	326.209324
ΔH_f, kcal/mol:	-379.5
Dipole, Da:	6.18
IP(EA), eV:	-10.38(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-5-[(1S,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxyoct-1-enyl]cyclopentyl]pent-3-enoic acid

Drug info:

PubChemData

Smile

CCCCC([C@@]1(CC[C@@H]2[C@@H](O1)CC(=O)[C@H]2CCCCCCC(=O)O)O)(F)F

DOS

IR

Vibrations