Geometry & MOs

Info

ID:	202745
PubChem CID:	79719315
Reduced:	ON5C13H21 (1)
Stoich.:	AB5C13D21 (1)
Weight, g/mol:	275.093086
ΔH_f, kcal/mol:	-6.21
Dipole, Da:	4.55
IP(EA), eV:	-8.7(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-yl]triazol-1-yl]ethanamine

Drug info:

PubChemData

Smile

CCN(CC1CCNCC1)C2=NC=CN=C2C(=O)N

DOS

IR

Vibrations