Geometry & MOs

Info

ID:	387982
PubChem CID:	134987640
Reduced:	NSSeO3C9H13 (1)
Stoich.:	ABCD3E9F13 (1)
Weight, g/mol:	341.94813
ΔH_f, kcal/mol:	-65.95
Dipole, Da:	4.13
IP(EA), eV:	-8.36(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-4-[(E)-1-chloro-1-phenylselanylprop-1-en-2-yl]benzene

Drug info:

PubChemData

Smile

C1COCCN1C(=S)[Se]C2=COCCO2

DOS

IR

Vibrations