Geometry & MOs

Info

ID:

74682

PubChem CID:

48422285

Reduced:

ClNO2C14H18 (1)

Stoich.:

ABC2D14E18 (1)

Weight, g/mol:

225.172879

ΔHf, kcal/mol:

-69.75

Dipole, Da:

3.96

IP(EA), eV:

-9.02(-0.19)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(2-methylpiperidin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC(=O)C(C)OCC2CC2

DOS

IR

Vibrations