Geometry & MOs

Info

ID:	157621
PubChem CID:	56436140
Reduced:	ON3C17H29 (1)
Stoich.:	AB3C17D29 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-47.98
Dipole, Da:	5.46
IP(EA), eV:	-8.6(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-ditert-butylpyrazol-3-yl)-5-methoxy-2-methyl-1-benzofuran-3-carboxamide

Drug info:

PubChemData

Smile

CC/C=C(/C)\C(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations