Geometry & MOs

Info

ID:	150392
PubChem CID:	53790081
Reduced:	ClSO2F3N5C17H19 (1)
Stoich.:	ABC2D3E5F17G19 (1)
Weight, g/mol:	376.103477
ΔH_f, kcal/mol:	-140.69
Dipole, Da:	6.36
IP(EA), eV:	-9.38(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(difluoromethoxy)pyridin-4-yl]oxy-6-[(4-fluorophenyl)methoxy]-4-methylpyridine

Drug info:

PubChemData

Smile

CC(C)(C)C(=NOC(=O)N(C)SC1=CC(=C(C=C1)Cl)C(F)(F)F)CN2C=NC=N2

DOS

IR

Vibrations