Geometry & MOs

Info

ID:	280991
PubChem CID:	103852334
Reduced:	N2O3F5H5C9 (1)
Stoich.:	A2B3C5D5E9 (1)
Weight, g/mol:	235.120843
ΔH_f, kcal/mol:	-264.59
Dipole, Da:	5.56
IP(EA), eV:	-10.48(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclobutylethyl)-2,4-dihydroxybenzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C(C(F)F)(F)F)F)[N+](=O)[O-]

DOS

IR

Vibrations