Geometry & MOs

Info

ID:	6338
PubChem CID:	68131
Reduced:	N2O5H6C7 (1)
Stoich.:	A2B5C6D7 (1)
Weight, g/mol:	198.027671
ΔH_f, kcal/mol:	-33.57
Dipole, Da:	5.42
IP(EA), eV:	-10.35(-2.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3,5-dinitrophenol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1O)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations