Geometry & MOs

Info

ID:	13383
PubChem CID:	228443
Reduced:	OC2H3 (6)
Stoich.:	AB2C3 (6)
Weight, g/mol:	258.110338
ΔH_f, kcal/mol:	-283.18
Dipole, Da:	4.92
IP(EA), eV:	-10.63(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-(2,2-dimethyl-6-oxooxan-4-yl)propanedioate

Drug info:

PubChemData

Smile

CC1(CC(CC(=O)O1)C(C(=O)OC)C(=O)OC)C

DOS

IR

Vibrations