Geometry & MOs

Info

ID:	354888
PubChem CID:	127287648
Reduced:	O2N4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	397.122003
ΔH_f, kcal/mol:	-58.74
Dipole, Da:	5.48
IP(EA), eV:	-9.28(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-2-fluorophenyl]-3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl]urea

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)NC(C)(C)C2=NOC(=N2)C

DOS

IR

Vibrations