Geometry & MOs

Info

ID:	217357
PubChem CID:	85087678
Reduced:	NO2C23H33 (1)
Stoich.:	AB2C23D33 (1)
Weight, g/mol:	352.109785
ΔH_f, kcal/mol:	-97.3
Dipole, Da:	5.65
IP(EA), eV:	-8.46(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3,4,5,6-pentafluorophenyl)methyl 9-oxononanoate

Drug info:

PubChemData

Smile

CCOC(=O)C=C(C)C1=CC2=C(C=C1)N(C=C2)C(CC(C)C)CC(C)C

DOS

IR

Vibrations