Geometry & MOs

Info

ID:	133116
PubChem CID:	51479151
Reduced:	SN2O5C17H18 (1)
Stoich.:	AB2C5D17E18 (1)
Weight, g/mol:	291.092915
ΔH_f, kcal/mol:	-105.27
Dipole, Da:	11.62
IP(EA), eV:	-9.52(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-methyl-4-naphthalen-2-ylsulfonylmorpholine

Drug info:

PubChemData

Smile

CCC1=C(C=C(S1)C(=O)O[C@@H](C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C

DOS

IR

Vibrations