Geometry & MOs

Info

ID:	358410
PubChem CID:	127295955
Reduced:	OSN5C16H27 (1)
Stoich.:	ABC5D16E27 (1)
Weight, g/mol:	385.147156
ΔH_f, kcal/mol:	-17.57
Dipole, Da:	6.97
IP(EA), eV:	-8.94(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-2-fluorophenyl]-1-methyl-1-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN=C(S1)NC(=O)N2CCC(C2)N3CCCCC3

DOS

IR

Vibrations