Geometry & MOs

Info

ID:	200937
PubChem CID:	79465408
Reduced:	OSN3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	254.106671
ΔH_f, kcal/mol:	-9.04
Dipole, Da:	2.41
IP(EA), eV:	-9.01(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-fluoro-4-nitrophenoxy)cyclohexan-1-amine

Drug info:

PubChemData

Smile

CCC1=CC2=C(N=CN=C2S1)OC3CCC(C3)N

DOS

IR

Vibrations