Geometry & MOs

Info

ID:	293055
PubChem CID:	117372674
Reduced:	BrNO3C8H10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	248.031872
ΔH_f, kcal/mol:	-73.13
Dipole, Da:	2.94
IP(EA), eV:	-9.23(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-difluoro-5-methylsulfonylphenyl)cyclopropan-1-ol

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1CNO)Br)O

DOS

IR

Vibrations