Geometry & MOs

Info

ID:	381356
PubChem CID:	134972067
Reduced:	NOC12H16 (1)
Stoich.:	ABC12D16 (1)
Weight, g/mol:	191.131014
ΔH_f, kcal/mol:	9.64
Dipole, Da:	1.55
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.974579
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-2-cyclopenta-2,4-dien-1-ylidene-1,3-oxazolidine

Drug info:

PubChemData

Smile

CC(C)(C)C1COC(=C2C=CC=C2)[N-]1

DOS

IR

Vibrations