Geometry & MOs

Info

ID:	80897
PubChem CID:	49846953
Reduced:	N8O8C37H46 (1)
Stoich.:	A8B8C37D46 (1)
Weight, g/mol:	288.09102
ΔH_f, kcal/mol:	-256.75
Dipole, Da:	7.91
IP(EA), eV:	-9.13(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[1-[(4-fluorophenyl)methyl]-2-oxopyridin-3-yl]-N-hydroxyprop-2-enamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCCC1C2=NC3=C(N2)C=C(C=C3)C4=COC(=C4)C(=O)C5=CN=C(N5)C6CCCN6C(=O)C(C(C)C)NC(=O)OC)NC(=O)OC

DOS

IR

Vibrations