Geometry & MOs

Info

ID:	13185
PubChem CID:	222673
Reduced:	SN3C6H9 (1)
Stoich.:	AB3C6D9 (1)
Weight, g/mol:	155.051718
ΔH_f, kcal/mol:	24.66
Dipole, Da:	1.18
IP(EA), eV:	-9.25(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-amino-2-methylpyrimidin-5-yl)methanethiol

Drug info:

PubChemData

Smile

CC1=NC=C(C(=N1)N)CS

DOS

IR

Vibrations