Geometry & MOs

Info

ID:	58584
PubChem CID:	24707765
Reduced:	NOC8H8 (2)
Stoich.:	ABC8D8 (2)
Weight, g/mol:	265.077265
ΔH_f, kcal/mol:	-10.27
Dipole, Da:	4.1
IP(EA), eV:	-8.87(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)/C(=N/O)/C

DOS

IR

Vibrations