Geometry & MOs

Info

ID:	237581
PubChem CID:	92719820
Reduced:	SN2O4H22C26 (1)
Stoich.:	AB2C4D22E26 (1)
Weight, g/mol:	480.114378
ΔH_f, kcal/mol:	-69.86
Dipole, Da:	7.39
IP(EA), eV:	-8.18(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7R)-7-(furan-2-yl)-3-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1,6,7,8-tetrahydroquinoline-2,5-dione

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H]2CC3=C(C=C(C(=O)N3)C4=NC(=CS4)C5=CC=C(C=C5)OC)C(=O)C2

DOS

IR

Vibrations