Geometry & MOs

Info

ID:	9380
PubChem CID:	88764
Reduced:	BrN3C14H16 (1)
Stoich.:	AB3C14D16 (1)
Weight, g/mol:	305.05276
ΔH_f, kcal/mol:	23.95
Dipole, Da:	1.36
IP(EA), eV:	-8.87(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(naphthalen-1-ylmethyl)-1,2,5,6-tetrahydro-1,2,4-triazine;hydrobromide

Drug info:

PubChemData

Smile

C1CN=C(NN1)CC2=CC=CC3=CC=CC=C32.Br

DOS

IR

Vibrations