Geometry & MOs

Info

ID:	223583
PubChem CID:	85335272
Reduced:	ON8C24H34 (1)
Stoich.:	AB8C24D34 (1)
Weight, g/mol:	445.12269
ΔH_f, kcal/mol:	57.99
Dipole, Da:	4.01
IP(EA), eV:	-8.86(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(4-chlorophenyl)sulfonyl-6-methylpiperidin-2-yl]methyl]-1H-indole-3-carboxamide

Drug info:

PubChemData

Smile

CCC(C1NC2C(CNN2)C(=O)N1CC3=CC=CC=C3)N4CCCN(CC4)C5=NC=CC=N5

DOS

IR

Vibrations