Geometry & MOs

Info

ID:	349710
PubChem CID:	127275862
Reduced:	S2N3O3C18H23 (1)
Stoich.:	A2B3C3D18E23 (1)
Weight, g/mol:	395.097349
ΔH_f, kcal/mol:	-85.55
Dipole, Da:	6.1
IP(EA), eV:	-9.09(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-4-morpholin-4-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC(C)C3=NC(=CS3)C

DOS

IR

Vibrations