Geometry & MOs

Info

ID:	391665
PubChem CID:	135008052
Reduced:	NSO3C21H25 (1)
Stoich.:	ABC3D21E25 (1)
Weight, g/mol:	267.183444
ΔH_f, kcal/mol:	-97.17
Dipole, Da:	4.92
IP(EA), eV:	-8.62(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 5-(cyclohexylidenemethyl)-1,2-oxazolidine-2-carboxylate

Drug info:

PubChemData

Smile

CCCCCC(C1=CC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)C)O

DOS

IR

Vibrations