Geometry & MOs

Info

ID:	379792
PubChem CID:	134464903
Reduced:	ClSO3N4C21H23 (1)
Stoich.:	ABC3D4E21F23 (1)
Weight, g/mol:	422.177899
ΔH_f, kcal/mol:	-45.78
Dipole, Da:	7.57
IP(EA), eV:	-8.63(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,3-difluoroazetidin-1-yl)methyl]-6-[2-[(2-methylpyrimidin-4-yl)amino]pyridin-4-yl]pyrazolo[1,5-a]pyridin-4-amine

Drug info:

PubChemData

Smile

C/C=C(\C=C(\NC(=O)C)/N=C)/C1=CC(=C(N=C1)C)NS(=O)(=O)C2=C(C=C(C=C2)C)Cl

DOS

IR

Vibrations