Geometry & MOs

Info

ID:	312490
PubChem CID:	126605827
Reduced:	BrFOSN4C13H16 (1)
Stoich.:	ABCDE4F13G16 (1)
Weight, g/mol:	400.111773
ΔH_f, kcal/mol:	-40.3
Dipole, Da:	2.43
IP(EA), eV:	-9.62(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-fluoro-3-methylsulfinylimidazo[1,5-a]pyridin-1-yl)-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

Drug info:

PubChemData

Smile

CC(C(C)(C)C)NC(=O)C1=CN(C2=NC=C(N=C12)Br)SF

DOS

IR

Vibrations