Geometry & MOs

Info

ID:	275302
PubChem CID:	103815029
Reduced:	ON5C8H15 (1)
Stoich.:	AB5C8D15 (1)
Weight, g/mol:	265.19026
ΔH_f, kcal/mol:	-15.9
Dipole, Da:	3.42
IP(EA), eV:	-9.93(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-piperidin-3-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]butanamide

Drug info:

PubChemData

Smile

CCC(C(=O)NC(C)C1=NC=NN1)N

DOS

IR

Vibrations