Geometry & MOs

Info

ID:	380666
PubChem CID:	134971186
Reduced:	N2O3H24C25 (1)
Stoich.:	A2B3C24D25 (1)
Weight, g/mol:	400.178693
ΔH_f, kcal/mol:	23.93
Dipole, Da:	4.07
IP(EA), eV:	-8.67(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,3aR,7R,7aR)-7-ethoxy-2,3,4-triphenyl-3,3a,7,7a-tetrahydro-[1,2]oxazolo[4,5-d]oxazine

Drug info:

PubChemData

Smile

CCO[C@H]1[C@@H]2[C@H](N(O[C@@H]2C(=NO1)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations