Geometry & MOs

Info

ID:	391348
PubChem CID:	135004444
Reduced:	NO4H11C15 (1)
Stoich.:	AB4C11D15 (1)
Weight, g/mol:	463.957454
ΔH_f, kcal/mol:	-15.11
Dipole, Da:	7.91
IP(EA), eV:	-8.97(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1Z)-1,2,3,4-tetrachloro-4-(2-phenylethylsulfanyl)buta-1,3-dienyl]sulfanylethylbenzene

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CC3=C(O2)C=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations