Geometry & MOs

Info

ID:	245642
PubChem CID:	99455739
Reduced:	ClN3O4C19H26 (1)
Stoich.:	AB3C4D19E26 (1)
Weight, g/mol:	371.220892
ΔH_f, kcal/mol:	-161.69
Dipole, Da:	1.48
IP(EA), eV:	-8.95(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)[C@@H](C)CNC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

DOS

IR

Vibrations