Geometry & MOs

Info

ID:	313128
PubChem CID:	126612098
Reduced:	O4C23H30 (1)
Stoich.:	A4B23C30 (1)
Weight, g/mol:	328.167459
ΔH_f, kcal/mol:	-156.77
Dipole, Da:	4.57
IP(EA), eV:	-8.56(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylphenoxy)ethyl 4-butoxybenzoate

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)C(C)(C)C

DOS

IR

Vibrations