Geometry & MOs

Info

ID:	211792
PubChem CID:	81054191
Reduced:	SN3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	279.140533
ΔH_f, kcal/mol:	-5.8
Dipole, Da:	4.05
IP(EA), eV:	-8.57(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[methyl(oxan-4-yl)amino]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)NCC2CCCCC2

DOS

IR

Vibrations