Geometry & MOs

Info

ID:	135491
PubChem CID:	51880498
Reduced:	Cl2N3O6H17C21 (1)
Stoich.:	A2B3C6D17E21 (1)
Weight, g/mol:	463.070176
ΔH_f, kcal/mol:	-198.76
Dipole, Da:	2.9
IP(EA), eV:	-8.92(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4S)-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

CC(=O)C1=CC2=C(C=C1NC(=O)CN3C(=O)[C@](NC3=O)(C)C4=C(C=C(C=C4)Cl)Cl)OCO2

DOS

IR

Vibrations