Geometry & MOs

Info

ID:	336469
PubChem CID:	127255476
Reduced:	ClNOC10H16 (1)
Stoich.:	ABCD10E16 (1)
Weight, g/mol:	209.978525
ΔH_f, kcal/mol:	-80.86
Dipole, Da:	1.37
IP(EA), eV:	-8.4(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(chloromethyl)-2-methylsulfanylpyrimidine;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OC1=CC=CC(=C1)N.Cl

DOS

IR

Vibrations