Geometry & MOs

Info

ID:	286766
PubChem CID:	104222313
Reduced:	ON2C7H12 (2)
Stoich.:	AB2C7D12 (2)
Weight, g/mol:	268.172168
ΔH_f, kcal/mol:	-60.71
Dipole, Da:	1.03
IP(EA), eV:	-8.53(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1CCN(C1)C2=NC=C(C=N2)CNCCOC)O

DOS

IR

Vibrations