Geometry & MOs

Info

ID:	53894
PubChem CID:	14718319
Reduced:	O6F7C16H21 (1)
Stoich.:	A6B7C16D21 (1)
Weight, g/mol:	208.193949
ΔH_f, kcal/mol:	-633.84
Dipole, Da:	1.13
IP(EA), eV:	-11.13(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-ethyl-1,6-diazatricyclo[7.4.0.02,6]tridecane

Drug info:

PubChemData

Smile

CCCCOC(=O)CC(C(=O)OCCCC)OC(=O)C(C(C(F)(F)F)(F)F)(F)F

DOS

IR

Vibrations