Geometry & MOs

Info

ID:	367861
PubChem CID:	127325992
Reduced:	ON5C19H23 (1)
Stoich.:	AB5C19D23 (1)
Weight, g/mol:	311.138225
ΔH_f, kcal/mol:	64.92
Dipole, Da:	11.77
IP(EA), eV:	-8.44(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethyl-1-methyl-2H-pyrazolo[3,4-c]pyrazol-4-yl)-1,3-dihydro-2-benzofuran-5-carboxamide

Drug info:

PubChemData

Smile

CCC1=C2C(=NN=C2N(N1)C)NC(=O)CC3CCC4=CC=CC=C4C3

DOS

IR

Vibrations