Geometry & MOs

Info

ID:	34319
PubChem CID:	7890748
Reduced:	NO4C23H23 (1)
Stoich.:	AB4C23D23 (1)
Weight, g/mol:	392.104208
ΔH_f, kcal/mol:	-119.22
Dipole, Da:	4.79
IP(EA), eV:	-8.67(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,5-dimethylanilino)-2-oxoethyl] 2-methoxy-5-sulfamoylbenzoate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)N2C(=CC(=C2C)C(=O)COC(=O)C3=CC=CC=C3O)C)C

DOS

IR

Vibrations