Geometry & MOs

Info

ID:	41620
PubChem CID:	8146598
Reduced:	O3N4H22C23 (1)
Stoich.:	A3B4C22D23 (1)
Weight, g/mol:	378.218152
ΔH_f, kcal/mol:	2.5
Dipole, Da:	5.65
IP(EA), eV:	-8.92(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

benzyl-[[(4R)-4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]methyl]-ethylazanium

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C[C@H]2COC3=CC=CC=C3O2)C)C(=O)CN4C5=CC=CC=C5N=N4

DOS

IR

Vibrations