Geometry & MOs

Info

ID:	237585
PubChem CID:	92719844
Reduced:	SN2O3H22C26 (1)
Stoich.:	AB2C3D22E26 (1)
Weight, g/mol:	476.120607
ΔH_f, kcal/mol:	-34.58
Dipole, Da:	6.49
IP(EA), eV:	-8.18(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=CSC(=N2)C3=CC4=C(C[C@H](CC4=O)C5=CC=CC=C5)NC3=O

DOS

IR

Vibrations