Geometry & MOs

Info

ID:	69892
PubChem CID:	47205702
Reduced:	O2N3C13H13 (1)
Stoich.:	A2B3C13D13 (1)
Weight, g/mol:	269.116427
ΔH_f, kcal/mol:	-19.27
Dipole, Da:	3.8
IP(EA), eV:	-8.65(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(1H-pyrazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC=N1)NC(=O)C2=CC=CC=N2

DOS

IR

Vibrations