Geometry & MOs

Info

ID:	342973
PubChem CID:	127266136
Reduced:	ClNSO4C15H22 (1)
Stoich.:	ABCD4E15F22 (1)
Weight, g/mol:	331.088972
ΔH_f, kcal/mol:	-173.69
Dipole, Da:	3.9
IP(EA), eV:	-9.02(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2-cyclopropyl-2-methoxyethyl)sulfonylamino]-6-fluorobenzoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NS(=O)(=O)CC(C2CCOCC2)OC)Cl

DOS

IR

Vibrations