Geometry & MOs

Info

ID:	34313
PubChem CID:	7890735
Reduced:	SN2O4H18C21 (1)
Stoich.:	AB2C4D18E21 (1)
Weight, g/mol:	408.099122
ΔH_f, kcal/mol:	-59.54
Dipole, Da:	2.15
IP(EA), eV:	-8.9(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl] 2-methoxy-5-sulfamoylbenzoate

Drug info:

PubChemData

Smile

C=CCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)COC(=O)C3=CC=CC=C3O

DOS

IR

Vibrations