Geometry & MOs

Info

ID:	148232
PubChem CID:	53787894
Reduced:	SF2N2C8H8 (1)
Stoich.:	AB2C2D8E8 (1)
Weight, g/mol:	428.219889
ΔH_f, kcal/mol:	-45.84
Dipole, Da:	2.75
IP(EA), eV:	-8.09(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(1R,2R)-2-[5-(1-benzofuran-2-yl)-3-hydroxypent-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoic acid

Drug info:

PubChemData

Smile

CSN=C(C1=C(C=CC=C1F)F)N

DOS

IR

Vibrations