Geometry & MOs

Info

ID:	145701
PubChem CID:	53577877
Reduced:	ON6C17H24 (1)
Stoich.:	AB6C17D24 (1)
Weight, g/mol:	342.149204
ΔH_f, kcal/mol:	20.01
Dipole, Da:	6.15
IP(EA), eV:	-9.11(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluoro-4-methylphenyl)-2-(1,4,6-trimethyl-3-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl)acetamide

Drug info:

PubChemData

Smile

CCN1CCN(C1=O)C2CCN(CC2)C3=C(C(=C(N=N3)C)C)C#N

DOS

IR

Vibrations