Geometry & MOs

Info

ID:	397704
PubChem CID:	135030597
Reduced:	SF3O6C46H48 (1)
Stoich.:	AB3C6D46E48 (1)
Weight, g/mol:	336.014853
ΔH_f, kcal/mol:	-298.53
Dipole, Da:	4.04
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.754625
Charge, e:	0

Chem-info

IUPAC name:

potassium;(2-imidazo[1,2-a]pyridin-2-ylphenoxy)carbonyl carbonate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2C(CC[S+]2[C@H]3C(C([C@@H](C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)C(F)(F)F

DOS

IR

Vibrations