Geometry & MOs

Info

ID:	134033
PubChem CID:	51627912
Reduced:	N2C13H20 (1)
Stoich.:	A2B13C20 (1)
Weight, g/mol:	432.14124
ΔH_f, kcal/mol:	16.91
Dipole, Da:	0.76
IP(EA), eV:	-8.7(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromo-3-methoxy-2-phenylmethoxyphenyl)methyl]-1-[(2S)-1-ethylpyrrolidin-2-yl]methanamine

Drug info:

PubChemData

Smile

C1C[C@H](CN(C1)CCN)C2=CC=CC=C2

DOS

IR

Vibrations