Geometry & MOs

Info

ID:	7277
PubChem CID:	71896
Reduced:	NO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	277.167794
ΔH_f, kcal/mol:	-125.09
Dipole, Da:	3.71
IP(EA), eV:	-9.45(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(8-hydroxy-6-methylundeca-2,4,6-trienoyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCCC(C=C(C)C=CC=CC(=O)N1CCCC1=O)O

DOS

IR

Vibrations