Geometry & MOs

Info

ID:	242375
PubChem CID:	96099907
Reduced:	O2N5C17H19 (1)
Stoich.:	A2B5C17D19 (1)
Weight, g/mol:	339.169525
ΔH_f, kcal/mol:	24.25
Dipole, Da:	5.46
IP(EA), eV:	-9.79(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-indazol-1-yl-1-[(2S)-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C(=O)N2CCC[C@H]2C3=NOC(=N3)C(C)C)C#N

DOS

IR

Vibrations