Geometry & MOs

Info

ID:	393888
PubChem CID:	135021915
Reduced:	O2N3H13C15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	382.061671
ΔH_f, kcal/mol:	31.27
Dipole, Da:	1.47
IP(EA), eV:	-8.44(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2,2-bis(benzylsulfanyl)ethenyl]-4-chlorobenzene

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3)N

DOS

IR

Vibrations