Geometry & MOs

Info

ID:	294232
PubChem CID:	117438622
Reduced:	O3C17H22 (1)
Stoich.:	A3B17C22 (1)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	-110.86
Dipole, Da:	6.16
IP(EA), eV:	-8.89(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]butanal

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2CCCC2)C3(CC3)CC(=O)O

DOS

IR

Vibrations