Geometry & MOs

Info

ID:	237576
PubChem CID:	92719798
Reduced:	N3O3C27H37 (1)
Stoich.:	A3B3C27D37 (1)
Weight, g/mol:	418.098728
ΔH_f, kcal/mol:	-109.06
Dipole, Da:	6.65
IP(EA), eV:	-8.63(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@]1(CN2C(=CC=C2C(=O)N1C3CCCCCC3)C4=CC=CO4)C(=O)NC5CCCCCC5

DOS

IR

Vibrations