Geometry & MOs

Info

ID:	375406
PubChem CID:	131500219
Reduced:	FNO4H6C8 (1)
Stoich.:	ABC4D6E8 (1)
Weight, g/mol:	197.068808
ΔH_f, kcal/mol:	-117.6
Dipole, Da:	1.06
IP(EA), eV:	-10.51(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(methoxymethyl)-2-methyl-6-nitrophenol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations