Geometry & MOs

Info

ID:	65126
PubChem CID:	29204504
Reduced:	SN3O5C22H23 (1)
Stoich.:	AB3C5D22E23 (1)
Weight, g/mol:	446.198777
ΔH_f, kcal/mol:	-125.22
Dipole, Da:	9.9
IP(EA), eV:	-9.12(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(diethylsulfamoyl)phenyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3

DOS

IR

Vibrations