Geometry & MOs

Info

ID:	306177
PubChem CID:	125002200
Reduced:	O2N3C17H21 (1)
Stoich.:	A2B3C17D21 (1)
Weight, g/mol:	358.200491
ΔH_f, kcal/mol:	-10.85
Dipole, Da:	5.59
IP(EA), eV:	-9.64(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-[2-[2-(dimethylamino)pyridin-4-yl]ethyl]morpholin-4-yl]-(3-ethyl-1,2-oxazol-5-yl)methanone

Drug info:

PubChemData

Smile

CCC1=CC(=NO1)C(=O)N2CCC[C@H]2CCC3=CC=NC=C3

DOS

IR

Vibrations