Geometry & MOs

Info

ID:	232318
PubChem CID:	87575986
Reduced:	ISN2O3F5H16C22 (1)
Stoich.:	ABC2D3E5F16G22 (1)
Weight, g/mol:	254.037958
ΔH_f, kcal/mol:	-233.79
Dipole, Da:	5.16
IP(EA), eV:	-8.7(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(2-chlorosulfonylcyclopropyl)-2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

COC1=CC(=C(C(=C1NS(=O)(=O)C2CC2C3=C(C=C(C=C3)F)F)NC4=C(C=C(C=C4)I)F)F)F

DOS

IR

Vibrations