Geometry & MOs

Info

ID:	305564
PubChem CID:	124960264
Reduced:	FON5C17H22 (1)
Stoich.:	ABC5D17E22 (1)
Weight, g/mol:	399.125277
ΔH_f, kcal/mol:	-23.34
Dipole, Da:	6.27
IP(EA), eV:	-8.2(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-(benzenesulfonyl)-2-[6-(3,5-dimethyl-1,2-oxazol-4-yl)pyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

CC1=CC(=NN1)CN(C)C(=O)[C@H]2CN(CCN2)C3=CC=C(C=C3)F

DOS

IR

Vibrations