Geometry & MOs

Info

ID:	287618
PubChem CID:	104248951
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	295.225977
ΔH_f, kcal/mol:	-60.35
Dipole, Da:	1.03
IP(EA), eV:	-9.88(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[3-(oxan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]ethyl]hexan-1-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)C(C2=NC(=NO2)CC3CCCCO3)N

DOS

IR

Vibrations