Geometry & MOs

Info

ID:	156143
PubChem CID:	56369313
Reduced:	SN2O4C26H30 (1)
Stoich.:	AB2C4D26E30 (1)
Weight, g/mol:	400.182064
ΔH_f, kcal/mol:	-109.29
Dipole, Da:	8.91
IP(EA), eV:	-8.58(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2,5-dimethylbenzoyl)piperidin-3-yl]methyl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)C(=O)CCC3=CC=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations