Geometry & MOs

Info

ID:	157627
PubChem CID:	56436176
Reduced:	O2N3C21H31 (1)
Stoich.:	A2B3C21D31 (1)
Weight, g/mol:	424.168145
ΔH_f, kcal/mol:	-68.24
Dipole, Da:	6.11
IP(EA), eV:	-8.67(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCOC2=CC=CC=C2)C(C)(C)C

DOS

IR

Vibrations