Geometry & MOs

Info

ID:	314925
PubChem CID:	126623975
Reduced:	FSN2O3H21C22 (1)
Stoich.:	ABC2D3E21F22 (1)
Weight, g/mol:	345.07283
ΔH_f, kcal/mol:	-120.07
Dipole, Da:	5.48
IP(EA), eV:	-8.47(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dibenzyl-3-(bromomethyl)oxetan-3-amine

Drug info:

PubChemData

Smile

C1CC[C@H](N(CC1)C(=O)O)C(=O)NC2=CC=CC(=C2F)C3=CSC4=CC=CC=C43

DOS

IR

Vibrations