Geometry & MOs

Info

ID:	21371
PubChem CID:	588042
Reduced:	BrF2N2O2C7H9 (1)
Stoich.:	AB2C2D2E7F9 (1)
Weight, g/mol:	269.98155
ΔH_f, kcal/mol:	-148.85
Dipole, Da:	4.62
IP(EA), eV:	-9.84(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-bromo-2,2-difluoro-1,1-dimethoxyethyl)-1H-imidazole

Drug info:

PubChemData

Smile

COC(C1=CN=CN1)(C(F)(F)Br)OC

DOS

IR

Vibrations