Geometry & MOs

Info

ID:	236288
PubChem CID:	92712230
Reduced:	SN3O3C28H39 (1)
Stoich.:	AB3C3D28E39 (1)
Weight, g/mol:	415.156577
ΔH_f, kcal/mol:	-138.96
Dipole, Da:	4.76
IP(EA), eV:	-8.8(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-[(5-methylfuran-2-yl)methyl]-1-(1-methylindol-5-yl)sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)N[C@H](C)C45CC6CC(C4)CC(C6)C5

DOS

IR

Vibrations