Geometry & MOs

Info

ID:	260807
PubChem CID:	103205106
Reduced:	ClN4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	236.082874
ΔH_f, kcal/mol:	43.98
Dipole, Da:	3.93
IP(EA), eV:	-8.95(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-2-methylpropyl)-1,2,4-benzotriazin-3-amine

Drug info:

PubChemData

Smile

CC1CCCC(C1)(CCl)NC2=NC3=CC=CC=C3N=N2

DOS

IR

Vibrations