Geometry & MOs

Info

ID:	298846
PubChem CID:	117661672
Reduced:	ClFN3O4H23C26 (1)
Stoich.:	ABC3D4E23F26 (1)
Weight, g/mol:	385.146013
ΔH_f, kcal/mol:	-129.06
Dipole, Da:	5.5
IP(EA), eV:	-9.07(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]-4-methylthiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C2C(=O)CC(C2=O)CCNC(=O)C3=CC=CC=N3)C)OC4=C(C=C(C=N4)Cl)F

DOS

IR

Vibrations