Geometry & MOs

Info

ID:	149166
PubChem CID:	53788838
Reduced:	O3H8C9 (1)
Stoich.:	A3B8C9 (1)
Weight, g/mol:	169.110279
ΔH_f, kcal/mol:	-93.55
Dipole, Da:	6.36
IP(EA), eV:	-9.93(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-(2-methylmorpholin-4-yl)prop-2-en-1-one

Drug info:

PubChemData

Smile

C1C2C=CC=CC2C(=O)OC1=O

DOS

IR

Vibrations