Geometry & MOs

Info

ID:	347043
PubChem CID:	127271547
Reduced:	O2N7C13H19 (1)
Stoich.:	A2B7C13D19 (1)
Weight, g/mol:	307.200825
ΔH_f, kcal/mol:	14.18
Dipole, Da:	4.67
IP(EA), eV:	-9.6(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopentyloxy-N-[2-(1,2,4-triazol-1-yl)ethyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2CCCN(C2)C(=O)NCCN3C=NC=N3

DOS

IR

Vibrations