Geometry & MOs

Info

ID:	237582
PubChem CID:	92719823
Reduced:	SN2O4H20C28 (1)
Stoich.:	AB2C4D20E28 (1)
Weight, g/mol:	472.109293
ΔH_f, kcal/mol:	-28.37
Dipole, Da:	7.61
IP(EA), eV:	-8.44(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S)-3-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-7-(4-methoxyphenyl)-1,6,7,8-tetrahydroquinoline-2,5-dione

Drug info:

PubChemData

Smile

C1[C@H](CC(=O)C2=C1NC(=O)C(=C2)C3=NC(=CS3)C4=CC=C(C=C4)OC5=CC=CC=C5)C6=CC=CO6

DOS

IR

Vibrations