Geometry & MOs

Info

ID:	149650
PubChem CID:	53789324
Reduced:	OSN2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	286.242729
ΔH_f, kcal/mol:	-1.6
Dipole, Da:	6.51
IP(EA), eV:	-8.01(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chlorooctadec-6-ene

Drug info:

PubChemData

Smile

CCC1=C(N(C(=S)N1)C2=CC=CC=C2C)O

DOS

IR

Vibrations