Geometry & MOs

Info

ID:	208561
PubChem CID:	80545111
Reduced:	ON2C14H22 (1)
Stoich.:	AB2C14D22 (1)
Weight, g/mol:	259.090997
ΔH_f, kcal/mol:	-48.8
Dipole, Da:	5.0
IP(EA), eV:	-9.38(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-(4-methylpentan-2-yl)-2-methylsulfanylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(CCN)C(=O)NC(C)CC1=CC=CC=C1

DOS

IR

Vibrations