Geometry & MOs

Info

ID:	368962
PubChem CID:	127330990
Reduced:	FSN3O4C17H18 (1)
Stoich.:	ABC3D4E17F18 (1)
Weight, g/mol:	393.09139
ΔH_f, kcal/mol:	-166.14
Dipole, Da:	1.96
IP(EA), eV:	-9.06(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-chlorophenyl)oxan-4-yl]-3-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)urea

Drug info:

PubChemData

Smile

C1COCC2=C1N=C(S2)NC(=O)NCCC3=CC(=CC4=C3OCOC4)F

DOS

IR

Vibrations