Geometry & MOs

Info

ID:	169163
PubChem CID:	75068859
Reduced:	N2O47H136C148 (1)
Stoich.:	A2B47C136D148 (1)
Weight, g/mol:	2681.798309
ΔH_f, kcal/mol:	-1545.55
Dipole, Da:	8.65
IP(EA), eV:	-9.44(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

Smile

CC(=O)OC1C(CC(OC1OCC=C)C(=O)NCC2=CC=C(C=C2)CNC(=O)C3C(C(C(C(O3)OCC=C)OC(=O)C)OC4C(C(C(C(O4)COC(=O)C5=CC=CC=C5)OC6C(C(C(C(O6)COC(=O)C7=CC=CC=C7)OC(=O)C8=CC=CC=C8)OC(=O)C9=CC=CC=C9)OC(=O)C1=CC=CC=C1)OC(=O)C1=CC=CC=C1)OC(=O)C1=CC=CC=C1)OC(=O)C)OC1C(C(C(C(O1)COC(=O)C1=CC=CC=C1)OC1C(C(C(C(O1)COC(=O)C1=CC=CC=C1)OC)OC(=O)C1=CC=CC=C1)OC(=O)C1=CC=CC=C1)OC(=O)C1=CC=CC=C1)OC(=O)C1=CC=CC=C1

DOS

IR

Vibrations