Geometry & MOs

Info

ID:	381759
PubChem CID:	134972587
Reduced:	ClON5C13H16 (1)
Stoich.:	ABC5D13E16 (1)
Weight, g/mol:	111.08099
ΔH_f, kcal/mol:	22.48
Dipole, Da:	5.04
IP(EA), eV:	-8.96(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-methyl-4-methylpent-1-en-3-one

Drug info:

PubChemData

Smile

CN1C2=C(C(=NC=N2)Cl)N=C1NC3CC4CC3CC4O

DOS

IR

Vibrations