Geometry & MOs

Info

ID:	157611
PubChem CID:	56436034
Reduced:	OSN6C24H34 (1)
Stoich.:	ABC6D24E34 (1)
Weight, g/mol:	343.225977
ΔH_f, kcal/mol:	18.33
Dipole, Da:	3.44
IP(EA), eV:	-8.72(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-ditert-butylpyrazol-3-yl)-2-phenoxypropanamide

Drug info:

PubChemData

Smile

CCN1C(=NN=C1SCC(=O)NC2=CC(=NN2C(C)(C)C)C(C)(C)C)C3=CC=CC(=C3)C

DOS

IR

Vibrations