Geometry & MOs

Info

ID:	280703
PubChem CID:	103850831
Reduced:	NO3F4C8H13 (1)
Stoich.:	AB3C4D8E13 (1)
Weight, g/mol:	304.087078
ΔH_f, kcal/mol:	-338.7
Dipole, Da:	3.78
IP(EA), eV:	-10.34(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-(4-hydroxy-1-methoxybutan-2-yl)-3-nitrobenzamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)C(C(F)F)(F)F

DOS

IR

Vibrations