Geometry & MOs

Info

ID:	358722
PubChem CID:	127296536
Reduced:	N3O3S3C16H19 (1)
Stoich.:	A3B3C3D16E19 (1)
Weight, g/mol:	319.192963
ΔH_f, kcal/mol:	-61.52
Dipole, Da:	4.06
IP(EA), eV:	-8.92(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-4-methylpiperidine-1-sulfonamide

Drug info:

PubChemData

Smile

C1CSCCN1C(=O)C2CSCN2S(=O)(=O)CC3=CC(=CC=C3)C#N

DOS

IR

Vibrations