Geometry & MOs

Info

ID:	363242
PubChem CID:	127310383
Reduced:	BrSO2N4C15H19 (1)
Stoich.:	ABC2D4E15F19 (1)
Weight, g/mol:	372.107911
ΔH_f, kcal/mol:	-34.77
Dipole, Da:	1.13
IP(EA), eV:	-9.04(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-3-[2-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]urea

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)NCC3=C(C=CS3)Br

DOS

IR

Vibrations