Geometry & MOs

Info

ID:	355444
PubChem CID:	127288507
Reduced:	ON7C16H17 (1)
Stoich.:	AB7C16D17 (1)
Weight, g/mol:	319.200825
ΔH_f, kcal/mol:	88.85
Dipole, Da:	3.84
IP(EA), eV:	-10.03(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-N-[2-oxo-2-[3-(1,2,4-triazol-1-yl)piperidin-1-yl]ethyl]acetamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)N3C=NN=C3)N4C=NC=N4

DOS

IR

Vibrations