Geometry & MOs

Info

ID:	254261
PubChem CID:	103123793
Reduced:	N5C11H15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	208.053115
ΔH_f, kcal/mol:	87.57
Dipole, Da:	5.66
IP(EA), eV:	-8.07(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-(1-methylpyrazol-3-yl)-1H-1,3,5-triazine-4-thione

Drug info:

PubChemData

Smile

CN1C=C/C(=C\2/N=C3CCCC(C3=N2)N)/N1

DOS

IR

Vibrations