Geometry & MOs

Info

ID:	210530
PubChem CID:	80819275
Reduced:	N5C13H25 (1)
Stoich.:	A5B13C25 (1)
Weight, g/mol:	251.210996
ΔH_f, kcal/mol:	10.97
Dipole, Da:	3.57
IP(EA), eV:	-8.51(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[2-(dimethylamino)propyl]-6-N-methyl-5-propylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCC1=C(N=CN=C1NCC(C)N(C)C)NCC

DOS

IR

Vibrations