Geometry & MOs

Info

ID:	84659
PubChem CID:	49869176
Reduced:	FON4H21C23 (1)
Stoich.:	ABC4D21E23 (1)
Weight, g/mol:	304.036318
ΔH_f, kcal/mol:	38.3
Dipole, Da:	2.86
IP(EA), eV:	-8.9(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-chloropyridazin-3-yl)-5-phenylmethoxy-1,3,4-oxadiazol-2-one

Drug info:

PubChemData

Smile

CC1=N[C@@](N=C1N)(CC2=CN=CC=C2)C3=CC=CC(=C3)C4=C(C(=CC=C4)OC)F

DOS

IR

Vibrations