Geometry & MOs

Info

ID:	27373
PubChem CID:	820986
Reduced:	BrON2H9C14 (1)
Stoich.:	ABC2D9E14 (1)
Weight, g/mol:	304.105922
ΔH_f, kcal/mol:	51.41
Dipole, Da:	6.03
IP(EA), eV:	-9.1(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R,4R)-2,4-dimethyl-1,3-dioxolan-2-yl]-N-(1,3-dioxoisoindol-2-yl)acetamide

Drug info:

PubChemData

Smile

C1=CC2=NC(=C(N2C=C1)Br)C3=CC=C(C=C3)C=O

DOS

IR

Vibrations