Geometry & MOs

Info

ID:	181444
PubChem CID:	76747717
Reduced:	WN2O4C20H28 (1)
Stoich.:	AB2C4D20E28 (1)
Weight, g/mol:	561.18239
ΔH_f, kcal/mol:	-56.42
Dipole, Da:	6.29
IP(EA), eV:	-6.85(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2,2-dimethyl-1,3-oxazolidin-4-ide-3-carboxylate;1-(4-ethylphenyl)-3-methylurea;tungsten(2+)

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C=[CH-].CC1(N([CH-]CO1)C(=O)OC(C)(C)C)C.[W+2]

DOS

IR

Vibrations