Geometry & MOs

Info

ID:	222458
PubChem CID:	85300778
Reduced:	O7C16H28 (1)
Stoich.:	A7B16C28 (1)
Weight, g/mol:	332.141245
ΔH_f, kcal/mol:	-321.88
Dipole, Da:	3.83
IP(EA), eV:	-9.99(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

16-methoxy-21,21-dimethyl-12,20-dioxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-2(11),3,5,7,9,14(19),15,17-octaene

Drug info:

PubChemData

Smile

CC(C)(C=CCC(C)(C=C)OC1C(C(C(C(O1)CO)O)O)O)O

DOS

IR

Vibrations