Geometry & MOs

Info

ID:	296608
PubChem CID:	117585669
Reduced:	ON4C13H20 (1)
Stoich.:	AB4C13D20 (1)
Weight, g/mol:	235.179696
ΔH_f, kcal/mol:	-15.78
Dipole, Da:	2.85
IP(EA), eV:	-8.69(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-(2-aminoethyl)-4-N-(cyclobutylmethyl)-2-methylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC(C)(C)N(C)C1=NC=NC(=C1)N2CCC(=O)C2

DOS

IR

Vibrations