Geometry & MOs

Info

ID:	5368
PubChem CID:	13053
Reduced:	FNO2H8C9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	181.053907
ΔH_f, kcal/mol:	-24.6
Dipole, Da:	3.39
IP(EA), eV:	-10.12(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-4-(2-nitroprop-1-enyl)benzene

Drug info:

PubChemData

Smile

CC(=CC1=CC=C(C=C1)F)[N+](=O)[O-]

DOS

IR

Vibrations