Geometry & MOs

Info

ID:	73898
PubChem CID:	48420948
Reduced:	N3O3C12H19 (1)
Stoich.:	A3B3C12D19 (1)
Weight, g/mol:	270.115047
ΔH_f, kcal/mol:	-114.44
Dipole, Da:	6.67
IP(EA), eV:	-8.6(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC(C)O)C(=O)NC1=CN=C(C=C1)OC

DOS

IR

Vibrations