Geometry & MOs

Info

ID:	211813
PubChem CID:	81054275
Reduced:	OSN3C15H25 (1)
Stoich.:	ABC3D15E25 (1)
Weight, g/mol:	279.140533
ΔH_f, kcal/mol:	-35.88
Dipole, Da:	5.43
IP(EA), eV:	-8.55(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[2-(oxolan-2-yl)ethylamino]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations