Geometry & MOs

Info

ID:	231988
PubChem CID:	87575074
Reduced:	NPO3C18H28 (1)
Stoich.:	ABC3D18E28 (1)
Weight, g/mol:	198.089209
ΔH_f, kcal/mol:	-178.95
Dipole, Da:	1.94
IP(EA), eV:	-8.72(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylprop-2-enoyloxymethyl (E)-2-methylbut-2-enoate

Drug info:

PubChemData

Smile

CCOP(=O)(/C(=C/C)/C1=CC=CC(=C1)CN2CCCC2)OCC

DOS

IR

Vibrations