Geometry & MOs

Info

ID:	12916
PubChem CID:	148327
Reduced:	OSN3C13H13 (1)
Stoich.:	ABC3D13E13 (1)
Weight, g/mol:	259.077933
ΔH_f, kcal/mol:	30.29
Dipole, Da:	3.06
IP(EA), eV:	-8.99(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-phenyl-1,3-thiazol-2-yl)-3-prop-2-enylurea

Drug info:

PubChemData

Smile

C=CCNC(=O)NC1=NC(=CS1)C2=CC=CC=C2

DOS

IR

Vibrations