Geometry & MOs

Info

ID:	283820
PubChem CID:	104011327
Reduced:	N2F3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	287.107005
ΔH_f, kcal/mol:	-158.77
Dipole, Da:	3.2
IP(EA), eV:	-9.2(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(3-fluoro-4-nitrophenyl)-2,3-dihydro-1H-indene-1,3-diamine

Drug info:

PubChemData

Smile

C1C(C2=CC=CC=C2C1NCCCCC(F)(F)F)N

DOS

IR

Vibrations