Geometry & MOs

Info

ID:

413176

PubChem CID:

135086121

Reduced:

N3O3C8H11 (1)

Stoich.:

A3B3C8D11 (1)

Weight, g/mol:

212.042649

ΔHf, kcal/mol:

-123.01

Dipole, Da:

5.37

IP(EA), eV:

-10.0(-0.57)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-chloropent-1-en-3-ylsulfanylbenzene

Drug info:

PubChemData

Smile

CCN1C(=C(C(=O)N(C1=O)C)C=O)N

DOS

IR

Vibrations