Geometry & MOs

Info

ID:	392346
PubChem CID:	135014616
Reduced:	BrOC8H11 (1)
Stoich.:	ABC8D11 (1)
Weight, g/mol:	193.146664
ΔH_f, kcal/mol:	-40.8
Dipole, Da:	5.21
IP(EA), eV:	-9.95(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4,7,10,10-tetramethyl-3-oxa-5-azatricyclo[5.2.1.02,6]dec-4-ene

Drug info:

PubChemData

Smile

CC1(CCC(=O)C=C1)CBr

DOS

IR

Vibrations