Geometry & MOs

Info

ID:	31140
PubChem CID:	854744
Reduced:	FO4H19C20 (1)
Stoich.:	AB4C19D20 (1)
Weight, g/mol:	283.120843
ΔH_f, kcal/mol:	-167.44
Dipole, Da:	1.18
IP(EA), eV:	-8.89(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-methylphenyl)methylcarbamoyl]phenyl] acetate

Drug info:

PubChemData

Smile

CC1=C(C2=C(O1)C=CC(=C2)OCC3=CC=C(C=C3)F)C(=O)OC(C)C

DOS

IR

Vibrations