Geometry & MOs

Info

ID:	437267
PubChem CID:	135220475
Reduced:	FSN3O3C11H12 (1)
Stoich.:	ABC3D3E11F12 (1)
Weight, g/mol:	366.149204
ΔH_f, kcal/mol:	-108.02
Dipole, Da:	7.31
IP(EA), eV:	-9.12(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(4-fluorophenyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl]pyridin-2-yl]propanamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N1C=C(C(=N1)C(=O)N)C2CC=C(C=C2)F

DOS

IR

Vibrations