Geometry & MOs

Info

ID:

190295

PubChem CID:

77981911

Reduced:

F2O4N5C25H27 (1)

Stoich.:

A2B4C5D25E27 (1)

Weight, g/mol:

575.345818

ΔHf, kcal/mol:

-167.15

Dipole, Da:

10.63

IP(EA), eV:

 -9.45(-1.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[5-[4,5-dihydroxy-6-(hydroxymethyl)-2-methyloxan-2-yl]oxy-3-hydroxy-2-(3-hydroxy-5-phenylpent-1-enyl)cyclopentyl]-N-ethylhept-5-enamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C(=O)O)C2=CC=CC=C2)NC(=O)NC3CN(CC3C4=CC(=C(C=C4)F)F)CCOC

DOS

IR

Vibrations