Geometry & MOs

Info

ID:	368680
PubChem CID:	127329816
Reduced:	NOSC6H12 (2)
Stoich.:	ABCD6E12 (2)
Weight, g/mol:	380.224597
ΔH_f, kcal/mol:	-110.79
Dipole, Da:	4.49
IP(EA), eV:	-8.28(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-4-ethylazepane-1-carboxamide

Drug info:

PubChemData

Smile

CSC1CCCC(C1)NS(=O)(=O)N2CCCCC2

DOS

IR

Vibrations