Geometry & MOs

Info

ID:	289775
PubChem CID:	104373136
Reduced:	SO4C11H12 (1)
Stoich.:	AB4C11D12 (1)
Weight, g/mol:	290.042436
ΔH_f, kcal/mol:	-133.57
Dipole, Da:	4.36
IP(EA), eV:	-10.45(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-difluorophenyl)sulfonyl-2-ethylcyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1CC1(C(=O)O)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations