Geometry & MOs

Info

ID:	13124
PubChem CID:	221751
Reduced:	O3C15H22 (1)
Stoich.:	A3B15C22 (1)
Weight, g/mol:	250.156895
ΔH_f, kcal/mol:	-139.8
Dipole, Da:	2.39
IP(EA), eV:	-8.55(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butylphenoxy)ethyl propanoate

Drug info:

PubChemData

Smile

CCC(=O)OCCOC1=CC=C(C=C1)C(C)(C)C

DOS

IR

Vibrations