Geometry & MOs

Info

ID:	404570
PubChem CID:	135066851
Reduced:	FNO2H12C18 (1)
Stoich.:	ABC2D12E18 (1)
Weight, g/mol:	378.121572
ΔH_f, kcal/mol:	-38.0
Dipole, Da:	5.23
IP(EA), eV:	-9.36(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-acetyloxy-5-methyl-2-(quinolin-8-ylcarbamoyl)phenyl] acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)F)C3=CC=CC=N3

DOS

IR

Vibrations