Geometry & MOs

Info

ID:	392330
PubChem CID:	135014560
Reduced:	O3C8H11 (2)
Stoich.:	A3B8C11 (2)
Weight, g/mol:	310.141638
ΔH_f, kcal/mol:	-235.13
Dipole, Da:	2.97
IP(EA), eV:	-10.22(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S,3aR,6R,6aR)-6-pent-4-enoyloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] pent-4-enoate

Drug info:

PubChemData

Smile

C=CCCC(=O)O[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2OC(=O)CCC=C

DOS

IR

Vibrations