Geometry & MOs

Info

ID:	211861
PubChem CID:	81054639
Reduced:	OSN2C16H24 (1)
Stoich.:	ABC2D16E24 (1)
Weight, g/mol:	268.124549
ΔH_f, kcal/mol:	-47.68
Dipole, Da:	4.0
IP(EA), eV:	-8.25(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-(2-propan-2-yloxyethoxy)pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCC1CCCCC1OC2=C(C(=NC(=C2)C)C)C(=S)N

DOS

IR

Vibrations