Geometry & MOs

Info

ID:	402089
PubChem CID:	135054304
Reduced:	O5C22H28 (1)
Stoich.:	A5B22C28 (1)
Weight, g/mol:	468.251598
ΔH_f, kcal/mol:	-213.79
Dipole, Da:	3.66
IP(EA), eV:	-8.87(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-5-[tert-butyl(dimethyl)silyl]oxy-1-(4-ethenyl-5-trimethylsilylfuran-2-yl)-2-methyl-2,5,6,7-tetrahydrocyclobuta[e]inden-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)[C@@H]2C=C3CC(C[C@H]3C(O2)(C)C)(C(=O)OC)C(=O)OC)C

DOS

IR

Vibrations