Geometry & MOs

Info

ID:	394142
PubChem CID:	135022413
Reduced:	NSiCl3O3C17H28 (1)
Stoich.:	ABC3D3E17F28 (1)
Weight, g/mol:	428.219889
ΔH_f, kcal/mol:	-181.06
Dipole, Da:	2.38
IP(EA), eV:	-8.86(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(9R,10S,13R)-4,5,17,18-tetramethoxy-10,12,12-trimethyl-11-oxatetracyclo[13.4.0.02,7.09,13]nonadeca-1(19),2,4,6,15,17-hexaen-10-ol

Drug info:

PubChemData

Smile

CC(C)[Si](C(C)C)(C(C)C)OC[C@H]1[C@H]2[C@@H](C=CO1)N=C(O2)C(Cl)(Cl)Cl

DOS

IR

Vibrations