Geometry & MOs

Info

ID:	447662
PubChem CID:	135284536
Reduced:	ClON5C18H22 (1)
Stoich.:	ABC5D18E22 (1)
Weight, g/mol:	541.256369
ΔH_f, kcal/mol:	35.53
Dipole, Da:	3.91
IP(EA), eV:	-9.15(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[4-[4-(difluoromethyl)-6-[2-(difluoromethyl)pyridin-4-yl]pyridin-3-yl]oxy-2-methylbutyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)C[C@@](C)(COC1=C(C=C(C=N1)C2=CC=NC3=CC=NN23)Cl)N

DOS

IR

Vibrations