Geometry & MOs

Info

ID:	233130
PubChem CID:	87692494
Reduced:	N7O18C55H59 (1)
Stoich.:	A7B18C55D59 (1)
Weight, g/mol:	530.135962
ΔH_f, kcal/mol:	-494.64
Dipole, Da:	8.86
IP(EA), eV:	-9.05(-2.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

Smile

C1=CC=C(C=C1)COC2=C(N=C(C(=O)C2=O)CCO)N(CCCC(CCCN(C3=C(C(=O)C(=O)C(=N3)CCO)OCC4=CC=CC=C4)C(=O)O)(CCCN(C5=C(C(=O)C(=O)C(=N5)CCO)OCC6=CC=CC=C6)C(=O)O)N)C(=O)O

DOS

IR

Vibrations