Geometry & MOs

Info

ID:	155306
PubChem CID:	56352892
Reduced:	N3O5C27H31 (1)
Stoich.:	A3B5C27D31 (1)
Weight, g/mol:	474.182458
ΔH_f, kcal/mol:	-186.92
Dipole, Da:	7.81
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC12CCC(=O)N1C3=CC=CC=C3C(=O)N2CCCC(=O)NC(C)(C)C4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations