Geometry & MOs

Info

ID:

201754

PubChem CID:

79576832

Reduced:

S2N3C15H23 (1)

Stoich.:

A2B3C15D23 (1)

Weight, g/mol:

146.049843

ΔHf, kcal/mol:

30.08

Dipole, Da:

4.37

IP(EA), eV:

-8.68(-0.52)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-chloro-1-(methoxymethyl)cyclopentene

Drug info:

PubChemData

Smile

CC1=CSC(=N1)SCCC2CCCC2(C#N)NC(C)C

DOS

IR

Vibrations