Geometry & MOs

Info

ID:	70723
PubChem CID:	48413776
Reduced:	O2N6C19H20 (1)
Stoich.:	A2B6C19D20 (1)
Weight, g/mol:	380.14193
ΔH_f, kcal/mol:	39.05
Dipole, Da:	2.22
IP(EA), eV:	-9.17(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1-propan-2-yl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=CC=CO4

DOS

IR

Vibrations