Geometry & MOs

Info

ID:	211343
PubChem CID:	80933179
Reduced:	ON4C14H24 (1)
Stoich.:	AB4C14D24 (1)
Weight, g/mol:	256.168797
ΔH_f, kcal/mol:	-54.91
Dipole, Da:	3.16
IP(EA), eV:	-8.76(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-benzyl-6-N,2-diethylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=N1)NC2CCC(CC2)O)NCC

DOS

IR

Vibrations