Geometry & MOs

Info

ID:	279496
PubChem CID:	103844119
Reduced:	FNO4H12C14 (1)
Stoich.:	ABC4D12E14 (1)
Weight, g/mol:	285.074956
ΔH_f, kcal/mol:	-87.23
Dipole, Da:	5.51
IP(EA), eV:	-9.75(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-hydroxyethyl)phenoxy]-5-nitropyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCO)OC2=C(C=C(C=C2)[N+](=O)[O-])F

DOS

IR

Vibrations