Geometry & MOs

Info

ID:	263924
PubChem CID:	103407827
Reduced:	ClNOSH10C11 (1)
Stoich.:	ABCDE10F11 (1)
Weight, g/mol:	287.95787
ΔH_f, kcal/mol:	-1.72
Dipole, Da:	1.33
IP(EA), eV:	-9.13(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-2-fluorophenyl)-(3-chloro-4-methylthiophen-2-yl)methanone

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C(C2=CN=CC=C2)O

DOS

IR

Vibrations