Geometry & MOs

Info

ID:	333831
PubChem CID:	127252383
Reduced:	O2N3C17H21 (1)
Stoich.:	A2B3C17D21 (1)
Weight, g/mol:	305.119798
ΔH_f, kcal/mol:	-27.13
Dipole, Da:	5.44
IP(EA), eV:	-9.22(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-3-methyl-3-(1H-pyrazol-5-yl)piperidine

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C(=O)COC2=CC=CC=C2)C3=CC=NN3

DOS

IR

Vibrations