Geometry & MOs

Info

ID:	382880
PubChem CID:	134974288
Reduced:	SiO3C23H30 (1)
Stoich.:	AB3C23D30 (1)
Weight, g/mol:	276.172545
ΔH_f, kcal/mol:	-155.93
Dipole, Da:	2.44
IP(EA), eV:	-8.81(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S,3R,5R,6S,7R,8R,9R,10R,14R)-6,7-dihydroxy-3,5-dimethyltetracyclo[7.5.1.02,8.010,14]pentadec-12-en-4-one

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC[C@H]1C[C@@H](C2=CC=CC=C12)OC(=O)C3=CC=CC=C3

DOS

IR

Vibrations