Geometry & MOs

Info

ID:	260792
PubChem CID:	103204518
Reduced:	SN4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	252.101111
ΔH_f, kcal/mol:	65.15
Dipole, Da:	0.65
IP(EA), eV:	-8.66(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,2,4-benzotriazin-3-yloxy)-5-methylaniline

Drug info:

PubChemData

Smile

CCSCC(C)NC1=NC2=CC=CC=C2N=N1

DOS

IR

Vibrations