Geometry & MOs

Info

ID:	221410
PubChem CID:	85272556
Reduced:	ON2H10C16 (1)
Stoich.:	AB2C10D16 (1)
Weight, g/mol:	246.125594
ΔH_f, kcal/mol:	131.5
Dipole, Da:	4.34
IP(EA), eV:	-9.13(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7',9'-dimethylspiro[1,3-dioxolane-2,10'-tricyclo[5.2.2.02,6]undeca-4,8-diene]-3'-one

Drug info:

PubChemData

Smile

C1=CC2C(=NC3=C(C2=O)C=CC4=C3C=CC=N4)C=C1

DOS

IR

Vibrations