Geometry & MOs

Info

ID:	199564
PubChem CID:	79266953
Reduced:	ClNSO2F3C12H15 (1)
Stoich.:	ABCD2E3F12G15 (1)
Weight, g/mol:	270.173213
ΔH_f, kcal/mol:	-245.13
Dipole, Da:	5.88
IP(EA), eV:	-10.28(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[(6-methylpyridin-2-yl)methoxy]-5-propan-2-ylaniline

Drug info:

PubChemData

Smile

CC(C)C(CCl)NS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

DOS

IR

Vibrations