Geometry & MOs

Info

ID:	26044
PubChem CID:	636883
Reduced:	O5H16C20 (1)
Stoich.:	A5B16C20 (1)
Weight, g/mol:	268.073559
ΔH_f, kcal/mol:	-140.09
Dipole, Da:	2.22
IP(EA), eV:	-8.87(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-2-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4(16),5,7,9,11,13-heptaene-6,13-diol

Drug info:

PubChemData

Smile

CC(=C)[C@H]1CC2=C(O1)C=C3C(=C2O)C(=O)C(=CO3)C4=CC=C(C=C4)O

DOS

IR

Vibrations