Geometry & MOs

Info

ID:	242359
PubChem CID:	96099891
Reduced:	N3O4C17H19 (1)
Stoich.:	A3B4C17D19 (1)
Weight, g/mol:	317.148789
ΔH_f, kcal/mol:	-73.04
Dipole, Da:	5.67
IP(EA), eV:	-9.02(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methoxypyridazin-3-yl)-[(2S)-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=CC4=C(C=C3)OCO4

DOS

IR

Vibrations