Geometry & MOs

Info

ID:	222361
PubChem CID:	85297263
Reduced:	FNOH26C28 (1)
Stoich.:	ABCD26E28 (1)
Weight, g/mol:	409.033681
ΔH_f, kcal/mol:	-13.3
Dipole, Da:	4.04
IP(EA), eV:	-7.94(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1C=C2C3=C(C=CC4=C3C(=CC(N4)(C)C)C)C5=C(O2)C=CC(=C5)F

DOS

IR

Vibrations