Geometry & MOs

Info

ID:	337985
PubChem CID:	127258608
Reduced:	O3C10H20 (1)
Stoich.:	A3B10C20 (1)
Weight, g/mol:	188.141244
ΔH_f, kcal/mol:	-167.82
Dipole, Da:	1.47
IP(EA), eV:	-9.71(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxypentan-2-yl butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCC(CC)OCC

DOS

IR

Vibrations