Geometry & MOs

Info

ID:	432878
PubChem CID:	135173015
Reduced:	FO2N8H25C28 (1)
Stoich.:	AB2C8D25E28 (1)
Weight, g/mol:	142.026609
ΔH_f, kcal/mol:	69.65
Dipole, Da:	1.94
IP(EA), eV:	-8.76(-2.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-3a,6a-dihydrofuro[3,2-b]furan-3-one

Drug info:

PubChemData

Smile

CCCC(NC1=CN=CC(=C1)C2=NC=C3C(=C2)/C(=C\4/N=C5C=NC=C(C5=N4)C6=CC(=CC(=C6)F)OC)/NN3)O

DOS

IR

Vibrations