Geometry & MOs

Info

ID:	180011
PubChem CID:	76566769
Reduced:	PO2N3H20C27 (1)
Stoich.:	AB2C3D20E27 (1)
Weight, g/mol:	171.11201
ΔH_f, kcal/mol:	84.78
Dipole, Da:	5.36
IP(EA), eV:	-8.14(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(aminodiazenyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)OC3C=CC4=NNC(=C5C=C6C=CC=CC6=N5)C4=C3

DOS

IR

Vibrations