Geometry & MOs

Info

ID:	222068
PubChem CID:	85293756
Reduced:	S2N4O9C20H20 (1)
Stoich.:	A2B4C9D20E20 (1)
Weight, g/mol:	524.205272
ΔH_f, kcal/mol:	-203.92
Dipole, Da:	2.7
IP(EA), eV:	-9.46(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]oxiran-2-yl]methyl 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C(=C2)CN3C(C(=O)NS3(=O)=O)NC(CSCC4=CC=CC=C4)C(=O)O)[N+](=O)[O-]

DOS

IR

Vibrations