Geometry & MOs

Info

ID:	423481
PubChem CID:	135119578
Reduced:	NSO2C7H11 (2)
Stoich.:	ABC2D7E11 (2)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	-154.1
Dipole, Da:	7.0
IP(EA), eV:	-9.58(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]cyclopent-3-ene-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)C(=O)N[C@H]2COC[C@H]2CS(=O)(=O)N(C)C

DOS

IR

Vibrations