Geometry & MOs

Info

ID:	260782
PubChem CID:	103203917
Reduced:	N5H11C15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	216.137497
ΔH_f, kcal/mol:	149.45
Dipole, Da:	4.77
IP(EA), eV:	-8.93(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-pentyl-1,2,4-benzotriazin-3-amine

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1C#N)C2=NC3=CC=CC=C3N=N2

DOS

IR

Vibrations