Geometry & MOs

Info

ID:	230629
PubChem CID:	87571523
Reduced:	Si5O6C18H44 (1)
Stoich.:	A5B6C18D44 (1)
Weight, g/mol:	545.089069
ΔH_f, kcal/mol:	-638.72
Dipole, Da:	4.09
IP(EA), eV:	-9.27(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-difluorophenoxy)-2-[4-(oxan-4-ylsulfonyl)phenyl]-N-([1,3]thiazolo[5,4-b]pyridin-2-yl)acetamide

Drug info:

PubChemData

Smile

CCCC(C(=C)C(=O)O)[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C

DOS

IR

Vibrations