Geometry & MOs

Info

ID:	219628
PubChem CID:	85163775
Reduced:	FOSCl3N5H13C20 (1)
Stoich.:	ABCD3E5F13G20 (1)
Weight, g/mol:	498.243765
ΔH_f, kcal/mol:	65.47
Dipole, Da:	4.96
IP(EA), eV:	-8.8(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-(3,3-diethoxyprop-1-ynyl)oxolane-3,4-diol

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NCN2C(=S)N(C=N2)N=CC3=CC=C(O3)C4=C(C=C(C=C4)Cl)Cl)Cl)F

DOS

IR

Vibrations