Geometry & MOs

Info

ID:	10312
PubChem CID:	100157
Reduced:	O8C23H24 (1)
Stoich.:	A8B23C24 (1)
Weight, g/mol:	428.147118
ΔH_f, kcal/mol:	-280.18
Dipole, Da:	4.02
IP(EA), eV:	-8.21(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1,2-dihydroxypropan-2-yl)-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one

Drug info:

PubChemData

Smile

CC(CO)(C1CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4C3=O)OC)OC)O

DOS

IR

Vibrations