Geometry & MOs

Info

ID:	172716
PubChem CID:	75543361
Reduced:	FSN4O4C20H25 (1)
Stoich.:	ABC4D4E20F25 (1)
Weight, g/mol:	427.166269
ΔH_f, kcal/mol:	-143.63
Dipole, Da:	4.24
IP(EA), eV:	-9.03(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(2-chlorophenyl)methyl]-2,6-dioxo-1,3-diazinan-1-yl]-N-(4-phenylbutan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)NC(=O)C2CC(NN2)C3=CC(=C(C=C3)OC)S(=O)(=O)N(C)C

DOS

IR

Vibrations