Geometry & MOs

Info

ID:	123791
PubChem CID:	50862189
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	551.0606
ΔH_f, kcal/mol:	-39.05
Dipole, Da:	11.23
IP(EA), eV:	-7.82(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dibromophenoxy)-N-[(E)-(2,2,4-trimethyl-1-propyl-3,4-dihydroquinolin-6-yl)methylideneamino]acetamide

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C=C2)/C=N/NC3=CC=C(C=C3)C(=O)O)C(CC1(C)C)C

DOS

IR

Vibrations