Geometry & MOs

Info

ID:	337930
PubChem CID:	127258553
Reduced:	NO3C9H19 (1)
Stoich.:	AB3C9D19 (1)
Weight, g/mol:	284.141245
ΔH_f, kcal/mol:	-164.87
Dipole, Da:	2.67
IP(EA), eV:	-9.51(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-phenylmethoxyphenyl)methyl butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCCC(C)NCO

DOS

IR

Vibrations