Geometry & MOs

Info

ID:	445221
PubChem CID:	135265130
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	230.128235
ΔH_f, kcal/mol:	-19.3
Dipole, Da:	5.16
IP(EA), eV:	-10.03(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-dimethylpentyl)-1,3,4-trifluorobenzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations