Geometry & MOs

Info

ID:	210696
PubChem CID:	80841577
Reduced:	ON6C14H24 (1)
Stoich.:	AB6C14D24 (1)
Weight, g/mol:	277.165108
ΔH_f, kcal/mol:	-6.53
Dipole, Da:	2.28
IP(EA), eV:	-8.98(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[4-(ethylamino)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]amino]butan-2-ol

Drug info:

PubChemData

Smile

CCCNC1=NC(=NC(=N1)N(C)C)NC2CC3CCC2O3

DOS

IR

Vibrations