Geometry & MOs

Info

ID:	217141
PubChem CID:	85087317
Reduced:	Br2N2C11H16 (1)
Stoich.:	A2B2C11D16 (1)
Weight, g/mol:	335.08848
ΔH_f, kcal/mol:	-4.39
Dipole, Da:	2.69
IP(EA), eV:	-8.82(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(1-phenylethyl)spiro[2.5]octane-2-carboxamide

Drug info:

PubChemData

Smile

CCCC(C(C1=NC(=CN=C1C)C)Br)Br

DOS

IR

Vibrations