Geometry & MOs

Info

ID:	45758
PubChem CID:	10517347
Reduced:	O2C8H15 (2)
Stoich.:	A2B8C15 (2)
Weight, g/mol:	286.225643
ΔH_f, kcal/mol:	-226.34
Dipole, Da:	2.85
IP(EA), eV:	-9.93(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-1-(3-cyclopentyloxy-2-hydroxypropyl)-3-ethylurea

Drug info:

PubChemData

Smile

CCCCCCCC[C@@H]([C@H](C)C(=O)CC)OC(=O)OC

DOS

IR

Vibrations