Geometry & MOs

Info

ID:	135492
PubChem CID:	51880499
Reduced:	Cl2N3O5H19C21 (1)
Stoich.:	A2B3C5D19E21 (1)
Weight, g/mol:	463.070176
ΔH_f, kcal/mol:	-166.39
Dipole, Da:	1.69
IP(EA), eV:	-8.53(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4R)-4-(2,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide

Drug info:

PubChemData

Smile

C[C@@]1(C(=O)N(C(=O)N1)CC(=O)NC2=CC3=C(C=C2)OCCCO3)C4=C(C=C(C=C4)Cl)Cl

DOS

IR

Vibrations