Geometry & MOs

Info

ID:	242251
PubChem CID:	96099309
Reduced:	O2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	289.117489
ΔH_f, kcal/mol:	-25.8
Dipole, Da:	3.54
IP(EA), eV:	-9.28(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-[(2R)-2-(5-methyl-1,2,4-oxadiazol-3-yl)pyrrolidine-1-carbonyl]pyridazin-3-one

Drug info:

PubChemData

Smile

CC1=NC(=NO1)[C@H]2CCCN2C(=O)[C@H]3CCC=CC3

DOS

IR

Vibrations