Geometry & MOs

Info

ID:	410543
PubChem CID:	135083342
Reduced:	O3C11H18 (1)
Stoich.:	A3B11C18 (1)
Weight, g/mol:	248.098104
ΔH_f, kcal/mol:	-162.97
Dipole, Da:	0.95
IP(EA), eV:	-9.9(2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-4-(trimethylsilylmethyl)oxadiazol-3-ium-5-olate

Drug info:

PubChemData

Smile

C1CCOC2(C1)CCC3(O2)CCCO3

DOS

IR

Vibrations