Geometry & MOs

Info

ID:	76954
PubChem CID:	48425622
Reduced:	BrN2O3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	333.130026
ΔH_f, kcal/mol:	-119.94
Dipole, Da:	6.09
IP(EA), eV:	-8.96(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-2-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCOC1=CC=C(C=C1)Br

DOS

IR

Vibrations