Geometry & MOs

Info

ID:	284913
PubChem CID:	104082463
Reduced:	O2C5H9 (2)
Stoich.:	A2B5C9 (2)
Weight, g/mol:	270.102272
ΔH_f, kcal/mol:	-196.31
Dipole, Da:	3.56
IP(EA), eV:	-10.12(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-chlorophenyl)methoxy]hexanoate

Drug info:

PubChemData

Smile

CCCCC(C(=O)O)OC1CCOC1

DOS

IR

Vibrations