Geometry & MOs

Info

ID:	209242
PubChem CID:	80641729
Reduced:	ClOSN2C14H21 (1)
Stoich.:	ABCD2E14F21 (1)
Weight, g/mol:	286.090662
ΔH_f, kcal/mol:	-43.62
Dipole, Da:	4.55
IP(EA), eV:	-9.03(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-piperidin-3-yl-N-propylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)NCC1CCCN(C1)C(=O)C2=C(C=CS2)Cl

DOS

IR

Vibrations