Geometry & MOs

Info

ID:	40935
PubChem CID:	8144985
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	381.147727
ΔH_f, kcal/mol:	-166.72
Dipole, Da:	1.61
IP(EA), eV:	-9.07(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(9-oxoacridin-10-yl)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide

Drug info:

PubChemData

Smile

CC[C@]1(C(=O)N(C(=O)N1)CN2CCC(CC2)C(=O)OCC)C3=CC=CC=C3

DOS

IR

Vibrations