Geometry & MOs

Info

ID:	382048
PubChem CID:	134972956
Reduced:	SiO3C24H36 (1)
Stoich.:	AB3C24D36 (1)
Weight, g/mol:	282.146724
ΔH_f, kcal/mol:	-98.13
Dipole, Da:	3.08
IP(EA), eV:	-8.66(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5R,8S,10S,12R,13R)-10-hydroperoxy-1,5-dimethyl-9-methylidene-11,14,15-trioxatetracyclo[10.2.1.04,13.08,13]pentadecane

Drug info:

PubChemData

Smile

CCCC#C[C@@H](C[C@@H](C#C)O[Si](C)(C)C(C)(C)C)OCC1=CC=C(C=C1)OC

DOS

IR

Vibrations