Geometry & MOs

Info

ID:	316080
PubChem CID:	126629970
Reduced:	Cl3N3O4C18H30 (1)
Stoich.:	A3B3C4D18E30 (1)
Weight, g/mol:	358.084993
ΔH_f, kcal/mol:	-228.3
Dipole, Da:	2.8
IP(EA), eV:	-9.27(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-[9-(5-methylthiophen-2-yl)fluoren-9-yl]thiophene

Drug info:

PubChemData

Smile

CCC[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H](N1)C(=O)OCC(Cl)(Cl)Cl

DOS

IR

Vibrations