Geometry & MOs

Info

ID:	73900
PubChem CID:	48420950
Reduced:	SO2N4C9H16 (1)
Stoich.:	AB2C4D9E16 (1)
Weight, g/mol:	312.161997
ΔH_f, kcal/mol:	-56.05
Dipole, Da:	6.79
IP(EA), eV:	-9.45(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-1-ethyl-1-(2-hydroxypropyl)urea

Drug info:

PubChemData

Smile

CCN(CC(C)O)C(=O)NC1=NN=C(S1)C

DOS

IR

Vibrations