Geometry & MOs

Info

ID:	195819
PubChem CID:	78735197
Reduced:	OBr2N4C14H16 (1)
Stoich.:	AB2C4D14E16 (1)
Weight, g/mol:	415.210721
ΔH_f, kcal/mol:	41.99
Dipole, Da:	4.5
IP(EA), eV:	-8.41(-2.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(cyclopropylamino)-2-oxo-1-phenylethyl] 2-[4-methyl-4-(3-methylbutyl)-2,5-dioxoimidazolidin-1-yl]acetate

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC2=NC(=O)C3=CC(=CC(C3=N2)Br)Br

DOS

IR

Vibrations