Geometry & MOs

Info

ID:	286769
PubChem CID:	104222325
Reduced:	SN4C14H24 (1)
Stoich.:	AB4C14D24 (1)
Weight, g/mol:	282.187818
ΔH_f, kcal/mol:	47.14
Dipole, Da:	0.98
IP(EA), eV:	-8.57(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(1-methylsulfanylbutan-2-yl)-5-(propylaminomethyl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC(CSC)N(C)C1=NC=C(C=N1)CNC2CC2

DOS

IR

Vibrations