Geometry & MOs

Info

ID:	181001
PubChem CID:	76714568
Reduced:	N2O3C15H20 (1)
Stoich.:	A2B3C15D20 (1)
Weight, g/mol:	307.097521
ΔH_f, kcal/mol:	-95.69
Dipole, Da:	2.78
IP(EA), eV:	-10.04(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorophenyl)-N-(5-hydroxy-4-oxopentyl)penta-2,4-dienamide

Drug info:

PubChemData

Smile

C1=CN=CC=C1C=CC(=O)NCCCCCC(=O)CO

DOS

IR

Vibrations