Geometry & MOs

Info

ID:	53094
PubChem CID:	14709550
Reduced:	O5C13H24 (1)
Stoich.:	A5B13C24 (1)
Weight, g/mol:	300.157288
ΔH_f, kcal/mol:	-236.63
Dipole, Da:	1.2
IP(EA), eV:	-10.04(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-O-(1-ethoxy-1-oxopropan-2-yl) 1-O-ethyl (4Z)-4-ethylidene-2-methylpentanedioate

Drug info:

PubChemData

Smile

CCC(OCC)(OCC)OC(C)C(=C)C(=O)OC

DOS

IR

Vibrations