Geometry & MOs

Info

ID:	404358
PubChem CID:	135066026
Reduced:	OSH14C16 (1)
Stoich.:	ABC14D16 (1)
Weight, g/mol:	345.230394
ΔH_f, kcal/mol:	23.13
Dipole, Da:	1.82
IP(EA), eV:	-9.24(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (1S,10Z)-4-methyl-2-oxo-13-azatricyclo[7.7.0.01,6]hexadeca-8,10-diene-13-carboxylate

Drug info:

PubChemData

Smile

CSC(=O)C=C(C1=CC=CC=C1)C2=CC=CC=C2

DOS

IR

Vibrations