Geometry & MOs

Info

ID:	415618
PubChem CID:	135088617
Reduced:	NO2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	333.216475
ΔH_f, kcal/mol:	-171.14
Dipole, Da:	3.5
IP(EA), eV:	-9.07(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopentanecarbonyl)-N-[2-(2-methyl-1,2,4-triazol-3-yl)ethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C[C@]1(CCOC2([C@H]1O)CCNCC2)NC(=O)CCC3=CC=CC=C3OC

DOS

IR

Vibrations