Geometry & MOs

Info

ID:	145849
PubChem CID:	53601816
Reduced:	SO2N5C15H17 (1)
Stoich.:	AB2C5D15E17 (1)
Weight, g/mol:	325.146013
ΔH_f, kcal/mol:	17.53
Dipole, Da:	2.7
IP(EA), eV:	-8.71(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfonyl-1-(3-imidazol-1-ylpiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=NC=NN2)C)C(=O)CSC3=NC(=C(O3)C)C

DOS

IR

Vibrations