Geometry & MOs

Info

ID:	210529
PubChem CID:	80819274
Reduced:	O2N5C13H17 (1)
Stoich.:	A2B5C13D17 (1)
Weight, g/mol:	251.210996
ΔH_f, kcal/mol:	38.57
Dipole, Da:	1.19
IP(EA), eV:	-8.87(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)NCCCCN2C=CN=C2)[N+](=O)[O-])N

DOS

IR

Vibrations