Geometry & MOs

Info

ID:

204068

PubChem CID:

79908525

Reduced:

N2O2C17H22 (1)

Stoich.:

A2B2C17D22 (1)

Weight, g/mol:

288.172545

ΔHf, kcal/mol:

-71.74

Dipole, Da:

2.7

IP(EA), eV:

-9.12(-0.57)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(2-methoxyphenyl)-1-(6-oxaspiro[4.5]decan-9-yl)ethanone

Drug info:

PubChemData

Smile

CC1(C(=O)N(C2=CC=CC=C2C(=O)N1)CC3CCCC3)C

DOS

IR

Vibrations