Geometry & MOs

Info

ID:	396580
PubChem CID:	135028797
Reduced:	N2O5C26H30 (1)
Stoich.:	A2B5C26D30 (1)
Weight, g/mol:	195.125929
ΔH_f, kcal/mol:	-156.96
Dipole, Da:	2.42
IP(EA), eV:	-8.33(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,6R,8S)-10,10-dimethyl-7-methylidene-9,11-dioxa-3-azatricyclo[6.3.0.03,6]undecane

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC=C(C1=O)C2C3=CC(=C(C=C3CCN2C4=CC=CC=C4)OC)OC

DOS

IR

Vibrations