Geometry & MOs

Info

ID:	243122
PubChem CID:	99215757
Reduced:	O2N3C24H29 (1)
Stoich.:	A2B3C24D29 (1)
Weight, g/mol:	366.115047
ΔH_f, kcal/mol:	-36.53
Dipole, Da:	4.55
IP(EA), eV:	-8.64(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-3-(1H-indole-3-carbonyl)-N-(pyridin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCCCC(=O)N2CCC(CC2)C3=CNC4=C3C=CC=N4

DOS

IR

Vibrations