Geometry & MOs

Info

ID:	203858
PubChem CID:	79883553
Reduced:	N3O4C12H15 (1)
Stoich.:	A3B4C12D15 (1)
Weight, g/mol:	249.091355
ΔH_f, kcal/mol:	-52.4
Dipole, Da:	9.67
IP(EA), eV:	-9.38(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-hydroxy-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide

Drug info:

PubChemData

Smile

CC(CCO)CNC1=NC2=C(O1)C=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations