Geometry & MOs

Info

ID:	123744
PubChem CID:	50860627
Reduced:	O2N5C21H27 (1)
Stoich.:	A2B5C21D27 (1)
Weight, g/mol:	505.12262
ΔH_f, kcal/mol:	45.5
Dipole, Da:	8.11
IP(EA), eV:	-7.98(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methylideneamino]-3-hydroxy-4-iodobenzamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)C)/C=N\NC3=C(C=CC=N3)[N+](=O)[O-])C(CC1(C)C)C

DOS

IR

Vibrations