Geometry & MOs

Info

ID:	383610
PubChem CID:	134975418
Reduced:	TeO2C8H10 (1)
Stoich.:	AB2C8D10 (1)
Weight, g/mol:	232.121178
ΔH_f, kcal/mol:	-50.56
Dipole, Da:	5.45
IP(EA), eV:	-8.48(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butan-2-yl-3-hydroxy-2-phenyl-1H-pyrazol-5-one

Drug info:

PubChemData

Smile

CC(=O)/C=C/[Te]/C=C\C(=O)C

DOS

IR

Vibrations