Geometry & MOs

Info

ID:	176505
PubChem CID:	76061776
Reduced:	SiO3C21H34 (1)
Stoich.:	AB3C21D34 (1)
Weight, g/mol:	257.137556
ΔH_f, kcal/mol:	-210.45
Dipole, Da:	2.36
IP(EA), eV:	-8.97(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6,7-trihydroxy-1,3-dimethyl-3a,4,5,5a,6,7,8,9a-octahydroimidazo[4,5-e]indolizin-2-one

Drug info:

PubChemData

Smile

CCC(=O)OC1CCCCC1C2=CC(=CC=C2)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations