Geometry & MOs

Info

ID:	386804
PubChem CID:	134982987
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	280.14633
ΔH_f, kcal/mol:	-122.43
Dipole, Da:	4.12
IP(EA), eV:	-9.19(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(13Z)-3,13,14-trimethyl-6,7-dihydrobenzo[e][1,4]benzodioxecine

Drug info:

PubChemData

Smile

CC(=O)OCC/C=C\C=C\C(=O)N(C)OC

DOS

IR

Vibrations