Geometry & MOs

Info

ID:	211034
PubChem CID:	80886466
Reduced:	SN3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	265.044046
ΔH_f, kcal/mol:	54.02
Dipole, Da:	0.51
IP(EA), eV:	-8.47(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-methyl-4-(2-methylphenyl)sulfanylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1SC2=NC(=NC=C2C)NC

DOS

IR

Vibrations