Geometry & MOs

Info

ID:	211029
PubChem CID:	80885742
Reduced:	SN3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	211.114319
ΔH_f, kcal/mol:	8.64
Dipole, Da:	2.78
IP(EA), eV:	-8.61(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-N-methyl-6-propan-2-ylsulfanylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=NC=CC(=N1)SC2CCCCC2

DOS

IR

Vibrations