Geometry & MOs

Info

ID:	78321
PubChem CID:	49684455
Reduced:	O2S2N4C15H20 (1)
Stoich.:	A2B2C4D15E20 (1)
Weight, g/mol:	360.161997
ΔH_f, kcal/mol:	-19.75
Dipole, Da:	5.09
IP(EA), eV:	-8.64(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-N-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)S(=O)(=O)NCC2CCN(CC2)C3=NC=CC=N3

DOS

IR

Vibrations