Geometry & MOs

Info

ID:	161833
PubChem CID:	57392807
Reduced:	O2N5C20H23 (1)
Stoich.:	A2B5C20D23 (1)
Weight, g/mol:	703.263997
ΔH_f, kcal/mol:	18.43
Dipole, Da:	5.82
IP(EA), eV:	-8.77(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-difluoro-5-[(4R)-3-[1-[[6-(4-methylsulfonylphenoxy)-2-propan-2-ylpyridin-3-yl]methyl]piperidin-4-yl]-2-oxo-4-phenylimidazolidin-1-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)N2C=CN=C2)CCCCNCC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations