Geometry & MOs

Info

ID:	178081
PubChem CID:	76274382
Reduced:	N4O5C24H28 (1)
Stoich.:	A4B5C24D28 (1)
Weight, g/mol:	450.230077
ΔH_f, kcal/mol:	-177.33
Dipole, Da:	3.61
IP(EA), eV:	-9.1(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methylpentanamide

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NC1=CC=CC(=C1)CN2C(=O)CNC2=O)NC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations