Geometry & MOs

Info

ID:	201130
PubChem CID:	79492042
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	291.08639
ΔH_f, kcal/mol:	-46.31
Dipole, Da:	4.73
IP(EA), eV:	-8.85(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(1-thiophen-2-ylpropan-2-yl)amino]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCNC(CC1=CC=NC2=CC=CC=C12)C(OC)OC

DOS

IR

Vibrations