Geometry & MOs

Info

ID:	342975
PubChem CID:	127266138
Reduced:	NSO6C15H23 (1)
Stoich.:	ABC6D15E23 (1)
Weight, g/mol:	343.108959
ΔH_f, kcal/mol:	-253.09
Dipole, Da:	3.87
IP(EA), eV:	-8.95(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(2-cyclopropyl-2-methoxyethyl)sulfonylamino]-3-hydroxybenzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=C(C=C1)NS(=O)(=O)CC(C(C)C)OC)O

DOS

IR

Vibrations