Geometry & MOs

Info

ID:	357113
PubChem CID:	127293339
Reduced:	ClO2N3C21H26 (1)
Stoich.:	AB2C3D21E26 (1)
Weight, g/mol:	296.10062
ΔH_f, kcal/mol:	-31.31
Dipole, Da:	2.74
IP(EA), eV:	-8.89(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-(2,2-difluoroethyl)-3-(1,1-dioxo-1,2-thiazolidin-2-yl)propanamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C(=NO2)C(=O)NCC3CCN(CC3)CC4=CC=CC=C4Cl

DOS

IR

Vibrations