Geometry & MOs

Info

ID:	69712
PubChem CID:	47205225
Reduced:	O2N4C13H14 (1)
Stoich.:	A2B4C13D14 (1)
Weight, g/mol:	289.061804
ΔH_f, kcal/mol:	-29.05
Dipole, Da:	6.91
IP(EA), eV:	-9.29(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-3-methyl-N-(1H-pyrazol-5-ylmethyl)-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC(=C1)C(=O)NCC2=CC=NN2

DOS

IR

Vibrations