Geometry & MOs

Info

ID:	242360
PubChem CID:	96099892
Reduced:	O3N5C15H19 (1)
Stoich.:	A3B5C15D19 (1)
Weight, g/mol:	317.148789
ΔH_f, kcal/mol:	-19.3
Dipole, Da:	4.21
IP(EA), eV:	-9.52(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methoxypyridazin-3-yl)-[(2R)-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)[C@@H]2CCCN2C(=O)C3=NN=C(C=C3)OC

DOS

IR

Vibrations