Geometry & MOs

Info

ID:	15234
PubChem CID:	434178
Reduced:	NO6C21H31 (1)
Stoich.:	AB6C21D31 (1)
Weight, g/mol:	393.215138
ΔH_f, kcal/mol:	-232.38
Dipole, Da:	2.9
IP(EA), eV:	-9.01(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(11-hydroxy-1,5-dimethyl-10-morpholin-4-ylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl)methyl acetate

Drug info:

PubChemData

Smile

CC1=CC2C(CC1)(C3(C(C(C(C34CO4)O2)N5CCOCC5)O)C)COC(=O)C

DOS

IR

Vibrations