Geometry & MOs

Info

ID:	221899
PubChem CID:	85292469
Reduced:	SiO3C21H32 (1)
Stoich.:	AB3C21D32 (1)
Weight, g/mol:	362.209324
ΔH_f, kcal/mol:	-146.7
Dipole, Da:	3.34
IP(EA), eV:	-8.91(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-acetyl-15-hydroxy-12-(2-hydroxyethyl)-4,13-dimethyl-16-oxatetracyclo[7.7.0.01,13.04,8]hexadec-9-en-11-one

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC(=C)OC1CC(C=C1)COCC2=CC=CC=C2

DOS

IR

Vibrations