Geometry & MOs

Info

ID:	372126
PubChem CID:	131293490
Reduced:	OBr2F3H5C8 (1)
Stoich.:	AB2C3D5E8 (1)
Weight, g/mol:	224.057276
ΔH_f, kcal/mol:	-167.19
Dipole, Da:	2.26
IP(EA), eV:	-9.77(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-amino-3-(3,5-difluoropyridin-2-yl)-2,2-difluoropropan-1-ol

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1OC(F)F)F)Br)CBr

DOS

IR

Vibrations