Geometry & MOs

Info

ID:	260799
PubChem CID:	103204681
Reduced:	N5C10H13 (1)
Stoich.:	A5B10C13 (1)
Weight, g/mol:	218.116761
ΔH_f, kcal/mol:	76.13
Dipole, Da:	2.68
IP(EA), eV:	-8.75(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1,2,4-benzotriazin-3-yl(methyl)amino]propan-1-ol

Drug info:

PubChemData

Smile

CC(CN)NC1=NC2=CC=CC=C2N=N1

DOS

IR

Vibrations