Geometry & MOs

Info

ID:	286767
PubChem CID:	104222319
Reduced:	SN4C13H24 (1)
Stoich.:	AB4C13D24 (1)
Weight, g/mol:	268.172168
ΔH_f, kcal/mol:	23.87
Dipole, Da:	3.03
IP(EA), eV:	-8.55(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(tert-butylamino)methyl]-N-methyl-N-(2-methylsulfanylethyl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC(C)CNCC1=CN=C(N=C1)N(C)CCSC

DOS

IR

Vibrations