Geometry & MOs

Info

ID:	180757
PubChem CID:	76681358
Reduced:	FN9O14C41H60 (1)
Stoich.:	AB9C14D41E60 (1)
Weight, g/mol:	2075.139736
ΔH_f, kcal/mol:	-545.03
Dipole, Da:	5.12
IP(EA), eV:	-8.71(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CCN5C=C(N=N5)CCC6CC(C(C(C6OC7C(C(C(C(O7)CO)O)N)O)O)OC8C(C(C(C(O8)CN)O)O)O)N)F)OC=O

DOS

IR

Vibrations