Geometry & MOs

Info

ID:	287496
PubChem CID:	104245380
Reduced:	OSN3C16H23 (1)
Stoich.:	ABC3D16E23 (1)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	21.93
Dipole, Da:	2.39
IP(EA), eV:	-9.04(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-2-[3-(pyridin-3-ylmethyl)-1,2,4-oxadiazol-5-yl]ethanamine

Drug info:

PubChemData

Smile

CCNC(CC1=NC(=NO1)CC2=CC=CS2)C3CCCC3

DOS

IR

Vibrations