Geometry & MOs

Info

ID:	192882
PubChem CID:	78321902
Reduced:	SF2N3O4H21C27 (1)
Stoich.:	AB2C3D4E21F27 (1)
Weight, g/mol:	341.104338
ΔH_f, kcal/mol:	-133.53
Dipole, Da:	5.0
IP(EA), eV:	-9.84(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[5-chloro-4-(3,5-dimethylpyridin-2-yl)pyridin-2-yl]-6,7-dihydro-4H-[1,2,5]oxadiazolo[3,4-c]pyridine

Drug info:

PubChemData

Smile

CCS(=O)(=O)C1=CC=C(C=C1)CC(=O)NC2=NC=C(C(=N2)C(=O)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

DOS

IR

Vibrations