Geometry & MOs

Info

ID:	51733
PubChem CID:	12014461
Reduced:	NOBr2H9C10 (2)
Stoich.:	ABC2D9E10 (2)
Weight, g/mol:	201.15175
ΔH_f, kcal/mol:	-0.77
Dipole, Da:	10.57
IP(EA), eV:	-8.95(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-phenylprop-2-enyl)cyclopentanamine

Drug info:

PubChemData

Smile

C1C[C@H]([C@@H](CC1)N/C=C\2/C(=O)C(=CC(=C2)Br)Br)N/C=C\3/C(=O)C(=CC(=C3)Br)Br

DOS

IR

Vibrations