Geometry & MOs

Info

ID:	13453
PubChem CID:	233399
Reduced:	NO2C5H6 (2)
Stoich.:	AB2C5D6 (2)
Weight, g/mol:	224.079707
ΔH_f, kcal/mol:	-19.32
Dipole, Da:	5.35
IP(EA), eV:	-10.2(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,3,5-tetramethyl-4,6-dinitrobenzene

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1C)[N+](=O)[O-])C)[N+](=O)[O-])C

DOS

IR

Vibrations