Geometry & MOs

Info

ID:	64137
PubChem CID:	29196322
Reduced:	FSN3O5C22H22 (1)
Stoich.:	ABC3D5E22F22 (1)
Weight, g/mol:	475.156577
ΔH_f, kcal/mol:	-163.44
Dipole, Da:	4.11
IP(EA), eV:	-9.16(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5S)-3-cyclopropyl-2-naphthalen-1-ylimino-4-oxo-1,3-thiazolidin-5-yl]-N-(2,4-dimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCNC(=O)C2=CC(=O)C3=CC=CC=C3O2)S(=O)(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations