Geometry & MOs

Info

ID:	199101
PubChem CID:	79197244
Reduced:	O2C5H9 (2)
Stoich.:	A2B5C9 (2)
Weight, g/mol:	216.136159
ΔH_f, kcal/mol:	-188.94
Dipole, Da:	2.9
IP(EA), eV:	-9.7(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-ethyl-4-methoxy-4-methyl-3-oxopentanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations