Geometry & MOs

Info

ID:	124020
PubChem CID:	50869928
Reduced:	ON2C27H30 (1)
Stoich.:	AB2C27D30 (1)
Weight, g/mol:	551.14197
ΔH_f, kcal/mol:	23.61
Dipole, Da:	6.44
IP(EA), eV:	-7.82(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-1-(4-bromo-2-methylphenyl)-5-[(7-methoxy-2,2,4-trimethyl-1-propylquinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C(=C2)OC)C=NC3=CC=CC4=CC=CC=C43)C(=CC1(C)C)C

DOS

IR

Vibrations