Geometry & MOs

Info

ID:	342301
PubChem CID:	127265078
Reduced:	ON2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	330.174356
ΔH_f, kcal/mol:	-79.65
Dipole, Da:	3.06
IP(EA), eV:	-8.96(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[1-(4-fluorophenyl)-3-methylbutan-2-yl]-2-oxo-1H-pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)COC)N[C@@H](C(C)C)C(=O)N2CCCC2

DOS

IR

Vibrations