Geometry & MOs

Info

ID:	240899
PubChem CID:	93618101
Reduced:	O2N4C17H26 (1)
Stoich.:	A2B4C17D26 (1)
Weight, g/mol:	333.172228
ΔH_f, kcal/mol:	-65.16
Dipole, Da:	2.6
IP(EA), eV:	-8.37(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-methylsulfonyl-N-[(2R)-1-morpholin-4-ylpropan-2-yl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](CN1CCOCC1)NC(=O)C2=C(N=CC=C2)N3CCCC3

DOS

IR

Vibrations