Geometry & MOs

Info

ID:	173002
PubChem CID:	75582450
Reduced:	SiN2O4C18H36 (1)
Stoich.:	AB2C4D18E36 (1)
Weight, g/mol:	489.174729
ΔH_f, kcal/mol:	-250.22
Dipole, Da:	2.86
IP(EA), eV:	-8.43(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3,12-bis(furan-2-yl)-6,6-dimethyl-2,11-dinitro-5,7,10-trioxatricyclo[6.2.2.04,9]dodecan-9-yl]pyrrolidine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C1C[Si](CN1CCC(C(=O)OC(C)(C)C)N)(C)C

DOS

IR

Vibrations