Geometry & MOs

Info

ID:	350417
PubChem CID:	127277779
Reduced:	SN3O4C17H27 (1)
Stoich.:	AB3C4D17E27 (1)
Weight, g/mol:	390.205576
ΔH_f, kcal/mol:	-175.75
Dipole, Da:	7.16
IP(EA), eV:	-8.99(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)N2CCCCC2C(=O)N3CCOCC3

DOS

IR

Vibrations