Geometry & MOs

Info

ID:	260798
PubChem CID:	103204653
Reduced:	N5C10H13 (1)
Stoich.:	A5B10C13 (1)
Weight, g/mol:	203.117095
ΔH_f, kcal/mol:	84.35
Dipole, Da:	2.42
IP(EA), eV:	-8.68(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(1,2,4-benzotriazin-3-yl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CN(CCN)C1=NC2=CC=CC=C2N=N1

DOS

IR

Vibrations