Geometry & MOs

Info

ID:	214944
PubChem CID:	85083896
Reduced:	Cl2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	660.26561
ΔH_f, kcal/mol:	18.92
Dipole, Da:	4.61
IP(EA), eV:	-9.12(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,10-bis(2-azido-4,5-dimethoxybenzoyl)-2,10-diazatricyclo[10.4.0.04,9]hexadecane-3,11-dione

Drug info:

PubChemData

Smile

CN1C2CCC1CC3(C2)CN=C(N3)C4=CC(=CC(=C4)Cl)Cl

DOS

IR

Vibrations