Geometry & MOs

Info

ID:	214142
PubChem CID:	81087006
Reduced:	ON3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	226.142976
ΔH_f, kcal/mol:	-43.68
Dipole, Da:	2.43
IP(EA), eV:	-8.64(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(aminomethyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pentanamide

Drug info:

PubChemData

Smile

CCC(CC(=O)N1CCN(CC1)C2CC2)CN

DOS

IR

Vibrations