Geometry & MOs

Info

ID:	211814
PubChem CID:	81054278
Reduced:	OSN3C14H21 (1)
Stoich.:	ABC3D14E21 (1)
Weight, g/mol:	293.156184
ΔH_f, kcal/mol:	-36.71
Dipole, Da:	5.22
IP(EA), eV:	-8.57(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)NCCC2CCCO2

DOS

IR

Vibrations