Geometry & MOs

Info

ID:	431183
PubChem CID:	135171253
Reduced:	O3N4C28H36 (1)
Stoich.:	A3B4C28D36 (1)
Weight, g/mol:	376.04365
ΔH_f, kcal/mol:	-95.49
Dipole, Da:	1.85
IP(EA), eV:	-9.22(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-iodobutyl)acridin-9-amine

Drug info:

PubChemData

Smile

CCN([C@H]1CCC[C@H](C1)N(CC2=CC=CC=C2)C(=O)OC(C)(C)C)C(=O)C3=NC4=CC=CC=C4N3

DOS

IR

Vibrations