Geometry & MOs

Info

ID:	139970
PubChem CID:	52623496
Reduced:	O2N5C14H23 (1)
Stoich.:	A2B5C14D23 (1)
Weight, g/mol:	372.08524
ΔH_f, kcal/mol:	-62.79
Dipole, Da:	2.14
IP(EA), eV:	-8.91(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(3-phenylpropyl)-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](COC)NC(=O)NC1CCN(CC1)C2=NC=CC=N2

DOS

IR

Vibrations