Geometry & MOs

Info

ID:	407792
PubChem CID:	135080547
Reduced:	NOC13H15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	212.042649
ΔH_f, kcal/mol:	-9.06
Dipole, Da:	4.09
IP(EA), eV:	-8.62(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-5-chloropent-1-enyl]sulfanylbenzene

Drug info:

PubChemData

Smile

CCC(=O)N1C2=CC=CC=C2C3C1(C3)C

DOS

IR

Vibrations