Geometry & MOs

Info

ID:	443902
PubChem CID:	135260336
Reduced:	ON9H27C28 (1)
Stoich.:	AB9C27D28 (1)
Weight, g/mol:	530.330776
ΔH_f, kcal/mol:	186.75
Dipole, Da:	5.69
IP(EA), eV:	-8.66(-2.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CN(C=N1)C2=NC=CC3=N/C(=C/4\C5=C(C=CC(=N5)C6=CC(=CN=C6)OCCN7CCCC7)NN4)/C=C32

DOS

IR

Vibrations