Geometry & MOs

Info

ID:	242387
PubChem CID:	96099919
Reduced:	O2N7C16H19 (1)
Stoich.:	A2B7C16D19 (1)
Weight, g/mol:	293.173942
ΔH_f, kcal/mol:	54.6
Dipole, Da:	4.18
IP(EA), eV:	-9.46(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2R)-2-ethoxycyclopropyl]-[(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)CC3=NN4C=CC=NC4=N3

DOS

IR

Vibrations