Geometry & MOs

Info

ID:	30948
PubChem CID:	853875
Reduced:	NOC17H19 (1)
Stoich.:	ABC17D19 (1)
Weight, g/mol:	141.036068
ΔH_f, kcal/mol:	-21.04
Dipole, Da:	6.14
IP(EA), eV:	-8.37(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-6-methyl-1H-pyrimidine-2-thione

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C(=O)C[C@@H]3N2CCC4=CC=CC=C34

DOS

IR

Vibrations