Geometry & MOs

Info

ID:	294398
PubChem CID:	117458670
Reduced:	ClFN2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	283.967685
ΔH_f, kcal/mol:	-60.47
Dipole, Da:	2.48
IP(EA), eV:	-8.76(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-3-hydroxy-4-methoxy-6-methylphenyl)methanesulfonyl chloride

Drug info:

PubChemData

Smile

CC(C)(C1=CC(=C(C=C1)C2CC(CN2C)CN)Cl)F

DOS

IR

Vibrations