Geometry & MOs

Info

ID:	410302
PubChem CID:	135083093
Reduced:	KC10H11 (1)
Stoich.:	AB10C11 (1)
Weight, g/mol:	169.089149
ΔH_f, kcal/mol:	58.27
Dipole, Da:	9.99
IP(EA), eV:	-6.11(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,8R,9S,11R)-10-azatetracyclo[6.3.2.02,7.09,11]trideca-2,4,6,12-tetraene

Drug info:

PubChemData

Smile

CC1(CC1)C2=CC=C[C-]=C2.[K+]

DOS

IR

Vibrations