Geometry & MOs

Info

ID:	13244
PubChem CID:	224077
Reduced:	N2O3H6C10 (2)
Stoich.:	A2B3C6D10 (2)
Weight, g/mol:	404.075684
ΔH_f, kcal/mol:	87.99
Dipole, Da:	3.79
IP(EA), eV:	-9.41(-2.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)-2,4,7-trinitrofluoren-9-imine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N=C2C3=C(C=CC(=C3)[N+](=O)[O-])C4=C2C=C(C=C4[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations