Geometry & MOs

Info

ID:	211318
PubChem CID:	80929566
Reduced:	OS2N4C9H16 (1)
Stoich.:	AB2C4D9E16 (1)
Weight, g/mol:	248.04986
ΔH_f, kcal/mol:	8.16
Dipole, Da:	4.53
IP(EA), eV:	-8.8(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloro-2-hydrazinylpyrimidin-4-yl)sulfanyl-2-methylpropan-1-ol

Drug info:

PubChemData

Smile

COCCCSC1=NC(=NC(=C1)NN)SC

DOS

IR

Vibrations