Geometry & MOs

Info

ID:	292388
PubChem CID:	115001252
Reduced:	ClSN3H8C10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	237.012746
ΔH_f, kcal/mol:	83.24
Dipole, Da:	5.69
IP(EA), eV:	-9.42(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-5-(3-methylphenyl)sulfanyl-1,2,4-triazine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)SC2=CN=NC(=N2)Cl

DOS

IR

Vibrations