Geometry & MOs

Info

ID:	44342
PubChem CID:	10502942
Reduced:	ClOSF2N5H14C19 (1)
Stoich.:	ABCD2E5F14G19 (1)
Weight, g/mol:	433.075072
ΔH_f, kcal/mol:	12.95
Dipole, Da:	6.54
IP(EA), eV:	-9.47(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-2,6-dimethoxy-5-methylphenyl)-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]methanone

Drug info:

PubChemData

Smile

CN1C(=NN=N1)C2=CC=C(C=C2)C3=CSC(=N3)C(CCl)(C4=C(C=C(C=C4)F)F)O

DOS

IR

Vibrations