Geometry & MOs

Info

ID:	382469
PubChem CID:	134973648
Reduced:	Br2N2O3H12C16 (1)
Stoich.:	A2B2C3D12E16 (1)
Weight, g/mol:	239.0171
ΔH_f, kcal/mol:	-37.1
Dipole, Da:	5.99
IP(EA), eV:	-9.27(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(iodomethyl)-1,5-dimethylpyrrolidine

Drug info:

PubChemData

Smile

COC1=CC(=NC2=C1C=CC3=C2N=C(C=C3)C(Br)Br)C(=O)OC

DOS

IR

Vibrations