Geometry & MOs

Info

ID:	195764
PubChem CID:	78732356
Reduced:	N3O5C22H23 (1)
Stoich.:	A3B5C22D23 (1)
Weight, g/mol:	343.121986
ΔH_f, kcal/mol:	-103.96
Dipole, Da:	6.17
IP(EA), eV:	-8.67(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-acetylanilino)-1-oxopropan-2-yl] 2-(3-fluorophenyl)acetate

Drug info:

PubChemData

Smile

CC(=NOCC(=O)NCC1=CC=C(C=C1)N2CCCC2=O)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations