Geometry & MOs

Info

ID:

411474

PubChem CID:

135084305

Reduced:

O4C7H8 (1)

Stoich.:

A4B7C8 (1)

Weight, g/mol:

203.131014

ΔHf, kcal/mol:

-135.59

Dipole, Da:

0.09

IP(EA), eV:

-9.74(-0.16)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[2-(2-methylidenebutyl)phenyl]acetamide

Drug info:

PubChemData

Smile

COC(=O)OCC1=COC=C1

DOS

IR

Vibrations