Geometry & MOs

Info

ID:	387600
PubChem CID:	134986079
Reduced:	O3C7H14 (1)
Stoich.:	A3B7C14 (1)
Weight, g/mol:	190.061652
ΔH_f, kcal/mol:	-134.38
Dipole, Da:	4.24
IP(EA), eV:	-9.46(1.64)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-methylidene-4-phenyl-1,2,4-triazolidin-1-ium-3,5-dione

Drug info:

PubChemData

Smile

COC(C1CCOC1)OC

DOS

IR

Vibrations