Geometry & MOs

Info

ID:	242258
PubChem CID:	96099429
Reduced:	O2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	311.163377
ΔH_f, kcal/mol:	-2.42
Dipole, Da:	3.73
IP(EA), eV:	-9.65(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-(5-methyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)[C@H]2CCCN2C(=O)CCC3=CN=CC=C3

DOS

IR

Vibrations