Geometry & MOs

Info

ID:	274422
PubChem CID:	103809218
Reduced:	SN2O2C12H18 (1)
Stoich.:	AB2C2D12E18 (1)
Weight, g/mol:	294.176585
ΔH_f, kcal/mol:	-81.44
Dipole, Da:	3.31
IP(EA), eV:	-9.22(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-ethylthiophen-2-yl)methyl]-3-piperidin-3-ylbutanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNC(=O)C2CC(CN2)O

DOS

IR

Vibrations