Geometry & MOs

Info

ID:	272997
PubChem CID:	103770038
Reduced:	ClF2N2O2C9H9 (1)
Stoich.:	AB2C2D2E9F9 (1)
Weight, g/mol:	328.96745
ΔH_f, kcal/mol:	-166.19
Dipole, Da:	4.29
IP(EA), eV:	-10.22(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(3,3-difluoro-2-hydroxypropyl)-2,6-difluorobenzamide

Drug info:

PubChemData

Smile

C1=CC(=NC=C1Cl)C(=O)NCC(C(F)F)O

DOS

IR

Vibrations