Geometry & MOs

Info

ID:	69965
PubChem CID:	47206071
Reduced:	SN3O3C11H13 (1)
Stoich.:	AB3C3D11E13 (1)
Weight, g/mol:	289.052112
ΔH_f, kcal/mol:	-59.55
Dipole, Da:	1.84
IP(EA), eV:	-8.94(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-2-ylmethyl)-3-[4-(furan-2-yl)-1,3-thiazol-2-yl]urea

Drug info:

PubChemData

Smile

COCCNC(=O)NC1=NC(=CS1)C2=CC=CO2

DOS

IR

Vibrations