Geometry & MOs

Info

ID:	339796
PubChem CID:	127261805
Reduced:	NOC14H23 (1)
Stoich.:	ABC14D23 (1)
Weight, g/mol:	281.141579
ΔH_f, kcal/mol:	6.77
Dipole, Da:	3.26
IP(EA), eV:	-9.06(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3aS)-2,3a-diphenyl-3,4,5,6-tetrahydro-2H-[1,2]oxazolo[2,3-b]oxazine

Drug info:

PubChemData

Smile

CC1CC(ON1C/C=C/CCCC=C)C=C

DOS

IR

Vibrations