Geometry & MOs

Info

ID:	123901
PubChem CID:	50864759
Reduced:	O2N3C26H29 (1)
Stoich.:	A2B3C26D29 (1)
Weight, g/mol:	444.216141
ΔH_f, kcal/mol:	-39.89
Dipole, Da:	3.68
IP(EA), eV:	-7.72(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4E)-2,5-dioxo-4-[(1,2,2,4,7-pentamethylquinolin-6-yl)methylidene]imidazolidin-1-yl]-N-phenylacetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)/C(=C\C3=CC4=C(C=C3C)N(C(C=C4C)(C)C)C)/NC2=O

DOS

IR

Vibrations