Geometry & MOs

Info

ID:	356417
PubChem CID:	127291490
Reduced:	O2S2N3C18H27 (1)
Stoich.:	A2B2C3D18E27 (1)
Weight, g/mol:	389.177313
ΔH_f, kcal/mol:	-69.66
Dipole, Da:	5.04
IP(EA), eV:	-8.82(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-3-(2-methylbutanoyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C)C(=O)N1CSCC1C(=O)NCCN2CCC3=C(C2)C=CS3

DOS

IR

Vibrations