Geometry & MOs

Info

ID:	339126
PubChem CID:	127260505
Reduced:	OC5H8 (4)
Stoich.:	AB5C8 (4)
Weight, g/mol:	303.074287
ΔH_f, kcal/mol:	-200.09
Dipole, Da:	2.21
IP(EA), eV:	-9.75(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxy-4-nitrophenoxy)ethyl benzoate

Drug info:

PubChemData

Smile

CCCCCCCCC(C(CCOC(=O)C1=CC=CC=C1)O)OC

DOS

IR

Vibrations