Geometry & MOs

Info

ID:	173684
PubChem CID:	75669053
Reduced:	ClSN4O5H17C18 (1)
Stoich.:	ABC4D5E17F18 (1)
Weight, g/mol:	438.076469
ΔH_f, kcal/mol:	-96.29
Dipole, Da:	4.14
IP(EA), eV:	-9.21(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2-chlorophenyl)sulfamoyl]-4-methylphenyl]-2-hydroxy-6-oxo-1,3-diazinane-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2CC(=O)NC(N2)[O-])S(=O)(=O)[N-]C3=CC=CC=C3Cl

DOS

IR

Vibrations