Geometry & MOs

Info

ID:	359047
PubChem CID:	127297291
Reduced:	SN3O3C17H27 (1)
Stoich.:	AB3C3D17E27 (1)
Weight, g/mol:	339.161663
ΔH_f, kcal/mol:	-110.18
Dipole, Da:	6.42
IP(EA), eV:	-8.84(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-2-ylmethyl)-3-piperidin-1-ylsulfonylpyridin-2-amine

Drug info:

PubChemData

Smile

CN(CC1CCCCO1)C2=C(C=CC=N2)S(=O)(=O)N3CCCCC3

DOS

IR

Vibrations