Geometry & MOs

Info

ID:	157838
PubChem CID:	56437520
Reduced:	SN3O5C17H25 (1)
Stoich.:	AB3C5D17E25 (1)
Weight, g/mol:	417.191323
ΔH_f, kcal/mol:	-215.28
Dipole, Da:	8.13
IP(EA), eV:	-8.2(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopropyl-3-methyl-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyridin-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCC(=O)NCC(=O)NC1=C(C=CC(=C1)N2CCCS2(=O)=O)O

DOS

IR

Vibrations