Geometry & MOs

Info

ID:	437395
PubChem CID:	135226204
Reduced:	FO2C7H8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	537.255146
ΔH_f, kcal/mol:	-248.8
Dipole, Da:	6.06
IP(EA), eV:	-9.89(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(cyclohexen-1-yl)-4-methyl-2-phenylpyrazol-3-yl]-3-[(4R,5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]urea

Drug info:

PubChemData

Smile

COCC[C@@H]1C[C@H]([C@@H](O1)C2=CC(=C(C=C2)F)F)C(=O)O

DOS

IR

Vibrations