Geometry & MOs

Info

ID:

338375

PubChem CID:

127259067

Reduced:

NO2C14H19 (1)

Stoich.:

AB2C14D19 (1)

Weight, g/mol:

215.039399

ΔHf, kcal/mol:

-70.64

Dipole, Da:

2.34

IP(EA), eV:

-8.8(0.35)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2,6-difluorophenyl)carbamoyl acetate

Drug info:

PubChemData

Smile

CCC1=C(C(=CC=C1)CC)N=CCOC(=O)C

DOS

IR

Vibrations