Geometry & MOs

Info

ID:	163241
PubChem CID:	57654997
Reduced:	O5C21H34 (1)
Stoich.:	A5B21C34 (1)
Weight, g/mol:	314.209324
ΔH_f, kcal/mol:	-274.36
Dipole, Da:	2.47
IP(EA), eV:	-9.84(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1-ethylcyclohexyl)oxy-2-oxoethoxy]ethyl 2-methylbutanoate

Drug info:

PubChemData

Smile

CCC(C)C(=O)OCCOCC(=O)OC1(C2CC3CC(C2)CC1C3)CC

DOS

IR

Vibrations