Geometry & MOs

Info

ID:	59781
PubChem CID:	24896866
Reduced:	ClON4H23C24 (1)
Stoich.:	ABC4D23E24 (1)
Weight, g/mol:	214.998535
ΔH_f, kcal/mol:	52.24
Dipole, Da:	3.97
IP(EA), eV:	-8.57(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chloro 2-(2-nitrophenyl)acetate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=C(C3=C(N2)C=C(C=C3)Cl)CCCN)OC4=CC=C(C=C4)C(=N)N

DOS

IR

Vibrations