Geometry & MOs

Info

ID:	216716
PubChem CID:	85086665
Reduced:	NSiO5C13H17 (1)
Stoich.:	ABC5D13E17 (1)
Weight, g/mol:	295.178358
ΔH_f, kcal/mol:	-109.53
Dipole, Da:	5.97
IP(EA), eV:	-9.65(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,8-dihydroxy-6-methyl-13-oxido-13-azoniatetracyclo[7.7.0.01,13.04,9]hexadecan-2-one

Drug info:

PubChemData

Smile

C[Si](C)(C)C1C(O1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations