Geometry & MOs

Info

ID:	359301
PubChem CID:	127298233
Reduced:	NSO5C16H21 (1)
Stoich.:	ABC5D16E21 (1)
Weight, g/mol:	380.140593
ΔH_f, kcal/mol:	-199.89
Dipole, Da:	8.15
IP(EA), eV:	-9.39(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2-oxo-N-[4-(oxolan-2-ylmethylsulfonyl)phenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(OC1)CS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCO3

DOS

IR

Vibrations