Geometry & MOs

Info

ID:	191488
PubChem CID:	78153929
Reduced:	ClSN3O4H14C17 (1)
Stoich.:	ABC3D4E14F17 (1)
Weight, g/mol:	475.174336
ΔH_f, kcal/mol:	-72.33
Dipole, Da:	8.38
IP(EA), eV:	-9.45(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-cyclopentyl-10-(2,3,4-trimethoxyphenyl)-8-oxa-13,14,16-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1,3,6,10,15-pentaene-5,12-dione

Drug info:

PubChemData

Smile

C1C2C(SCC(=O)N=C2NN1)C3=CC=C(O3)C4=C(C=CC(=C4)C(=O)O)Cl

DOS

IR

Vibrations