Geometry & MOs

Info

ID:	63985
PubChem CID:	26759621
Reduced:	ClN2O4C17H17 (1)
Stoich.:	AB2C4D17E17 (1)
Weight, g/mol:	495.149778
ΔH_f, kcal/mol:	-127.99
Dipole, Da:	2.55
IP(EA), eV:	-9.07(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(diethylsulfamoyl)-4-methylphenyl]-4-morpholin-4-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=C(N=CC=C1)Cl)OC(=O)CC2=CC=C(C=C2)OC

DOS

IR

Vibrations