Geometry & MOs

Info

ID:	376466
PubChem CID:	134222480
Reduced:	O3C7H10 (1)
Stoich.:	A3B7C10 (1)
Weight, g/mol:	170.057909
ΔH_f, kcal/mol:	-143.05
Dipole, Da:	5.75
IP(EA), eV:	-11.46(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-3,5,10-trioxatricyclo[5.2.1.02,6]decan-4-one

Drug info:

PubChemData

Smile

CC1CC2C(C1)OC(=O)O2

DOS

IR

Vibrations