Geometry & MOs

Info

ID:	403190
PubChem CID:	135059113
Reduced:	ClSH2F5C10 (1)
Stoich.:	ABC2D5E10 (1)
Weight, g/mol:	313.167794
ΔH_f, kcal/mol:	-170.29
Dipole, Da:	1.24
IP(EA), eV:	-9.55(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-acetylfuran-2-yl)-N,N-di(propan-2-yl)benzamide

Drug info:

PubChemData

Smile

C1=C(SC(=C1)Cl)C2=C(C(=C(C(=C2F)F)F)F)F

DOS

IR

Vibrations