Geometry & MOs

Info

ID:	45888
PubChem CID:	10518741
Reduced:	N2O3C17H22 (1)
Stoich.:	A2B3C17D22 (1)
Weight, g/mol:	306.183109
ΔH_f, kcal/mol:	-82.84
Dipole, Da:	3.23
IP(EA), eV:	-8.68(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S,6R,11R,16S)-4,7,12,17-tetraoxatetraspiro[4.0.46.0.411.0.416.25]docos-21-ene

Drug info:

PubChemData

Smile

[3H]C1[C@H]([C@H]2[C@@]34CCN([C@@H]([C@@]3(C1[3H])O)CC5=C4C(=C(C=C5)O)O2)C)N

DOS

IR

Vibrations