Geometry & MOs

Info

ID:	172972
PubChem CID:	75576579
Reduced:	SiO7C30H50 (1)
Stoich.:	AB7C30D50 (1)
Weight, g/mol:	302.188195
ΔH_f, kcal/mol:	-352.58
Dipole, Da:	2.45
IP(EA), eV:	-8.78(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4a,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one

Drug info:

PubChemData

Smile

CCOC(C)OC(CC=CC1C(C=CC(O1)O[Si](C)(C)C(C)(C)C)O)C(C)COCC2=CC=C(C=C2)OC

DOS

IR

Vibrations