Geometry & MOs

Info

ID:	280535
PubChem CID:	103849785
Reduced:	FNO2C11H12 (1)
Stoich.:	ABC2D11E12 (1)
Weight, g/mol:	237.100108
ΔH_f, kcal/mol:	-90.05
Dipole, Da:	4.71
IP(EA), eV:	-9.53(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C(C)OC1=C(C=C(C=C1)C#N)F)O

DOS

IR

Vibrations