Geometry & MOs

Info

ID:	9450
PubChem CID:	89628
Reduced:	N3C11H15 (1)
Stoich.:	A3B11C15 (1)
Weight, g/mol:	189.126598
ΔH_f, kcal/mol:	49.8
Dipole, Da:	1.84
IP(EA), eV:	-8.79(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-phenylethyl)-1,2,5,6-tetrahydro-1,2,4-triazine

Drug info:

PubChemData

Smile

C1CN=C(NN1)CCC2=CC=CC=C2

DOS

IR

Vibrations