Geometry & MOs

Info

ID:	196468
PubChem CID:	78835206
Reduced:	OF2S2N5H15C17 (1)
Stoich.:	AB2C2D5E15F17 (1)
Weight, g/mol:	420.136845
ΔH_f, kcal/mol:	-19.46
Dipole, Da:	4.5
IP(EA), eV:	-9.13(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-(2-methylphenyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl]amino]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)NC3=CC=CC=C3SC(F)F

DOS

IR

Vibrations