Geometry & MOs

Info

ID:	8924
PubChem CID:	83616
Reduced:	NO2H9C11 (1)
Stoich.:	AB2C9D11 (1)
Weight, g/mol:	187.063329
ΔH_f, kcal/mol:	25.75
Dipole, Da:	5.53
IP(EA), eV:	-9.42(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-1-nitronaphthalene

Drug info:

PubChemData

Smile

CC1=CC2=C(C=CC=C2[N+](=O)[O-])C=C1

DOS

IR

Vibrations