Geometry & MOs

Info

ID:	277429
PubChem CID:	103828470
Reduced:	F2O2N4H10C11 (1)
Stoich.:	A2B2C4D10E11 (1)
Weight, g/mol:	286.112899
ΔH_f, kcal/mol:	-29.7
Dipole, Da:	6.9
IP(EA), eV:	-9.02(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclopentyloxyethyl)-2,6-difluoro-4-nitroaniline

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)NC2=C(C=C(C=C2F)[N+](=O)[O-])F

DOS

IR

Vibrations