Geometry & MOs

Info

ID:	273052
PubChem CID:	103770395
Reduced:	BrF2N2O2C9H9 (1)
Stoich.:	AB2C2D2E9F9 (1)
Weight, g/mol:	269.047519
ΔH_f, kcal/mol:	-154.44
Dipole, Da:	4.31
IP(EA), eV:	-10.26(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-3,4,5-trifluorobenzamide

Drug info:

PubChemData

Smile

C1=CC(=NC=C1Br)C(=O)NCC(C(F)F)O

DOS

IR

Vibrations