Geometry & MOs

Info

ID:	187089
PubChem CID:	77529984
Reduced:	SN4O7C20H28 (1)
Stoich.:	AB4C7D20E28 (1)
Weight, g/mol:	454.188606
ΔH_f, kcal/mol:	-268.33
Dipole, Da:	7.24
IP(EA), eV:	-9.29(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-amino-1-(3-methylmorpholin-4-yl)-1-oxopropan-2-yl]-2-ethyl-3-(3-oxomorpholin-4-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1=C(C=CC=C1S(=O)(=O)NC(C(=O)N)C(=O)N2CCOCC2C)N3CCOCC3=O

DOS

IR

Vibrations