Geometry & MOs

Info

ID:	443017
PubChem CID:	135257418
Reduced:	ON2C4H7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	230.123972
ΔH_f, kcal/mol:	-62.67
Dipole, Da:	3.34
IP(EA), eV:	-9.42(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,12-dihydroxy-2,4,6,8,10,12-hexazatricyclo[7.3.0.03,7]dodec-1(9)-ene-5,11-diamine

Drug info:

PubChemData

Smile

C1C2C(NC1N)NC3C(=CC(O3)O)N2

DOS

IR

Vibrations