Geometry & MOs

Info

ID:	157637
PubChem CID:	56436194
Reduced:	O2N3C21H31 (1)
Stoich.:	A2B3C21D31 (1)
Weight, g/mol:	478.258006
ΔH_f, kcal/mol:	-71.6
Dipole, Da:	7.45
IP(EA), eV:	-8.53(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-ditert-butylpyrazol-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(=O)NC2=CC(=NN2C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations