Geometry & MOs

Info

ID:	413734
PubChem CID:	135086684
Reduced:	O2C15H20 (1)
Stoich.:	A2B15C20 (1)
Weight, g/mol:	355.139528
ΔH_f, kcal/mol:	-79.55
Dipole, Da:	1.88
IP(EA), eV:	-9.43(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3E)-2-oxo-3-[[3-(trifluoromethyl)phenyl]methylidene]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C/C1=CC=CC=C1)/CC(C)C

DOS

IR

Vibrations