Geometry & MOs

Info

ID:	210205
PubChem CID:	80774248
Reduced:	ON5C13H23 (1)
Stoich.:	AB5C13D23 (1)
Weight, g/mol:	291.217144
ΔH_f, kcal/mol:	-23.69
Dipole, Da:	2.46
IP(EA), eV:	-8.89(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-methyl-2-N-[(1-methylpyrrolidin-3-yl)methyl]-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCC1CCCCN1C2=NC(=NC(=N2)NC)OCC

DOS

IR

Vibrations