Geometry & MOs

Info

ID:	156553
PubChem CID:	56371102
Reduced:	N3O3C24H29 (1)
Stoich.:	A3B3C24D29 (1)
Weight, g/mol:	475.14705
ΔH_f, kcal/mol:	-45.29
Dipole, Da:	6.32
IP(EA), eV:	-8.65(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(1-cycloheptylpyrrolidin-3-yl)butanamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)N2CCC(C2)NC(=O)C3=CC=C(O3)COC4=CC=CC=C4C#N

DOS

IR

Vibrations