Geometry & MOs

Info

ID:	379684
PubChem CID:	134456559
Reduced:	O3N8C27H32 (1)
Stoich.:	A3B8C27D32 (1)
Weight, g/mol:	469.133924
ΔH_f, kcal/mol:	11.13
Dipole, Da:	2.55
IP(EA), eV:	-8.41(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[2-methoxy-3-(4-methyl-1,3-thiazol-2-yl)phenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine

Drug info:

PubChemData

Smile

CC1=NN(N=C1C2=C(C(=CC=C2)NC3=CC(=NC4=C3N=C(N4C5CCCCO5)C)NC(=O)C6CC6)OC)C

DOS

IR

Vibrations