Geometry & MOs

Info

ID:	295997
PubChem CID:	117549633
Reduced:	ON2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	221.121592
ΔH_f, kcal/mol:	21.58
Dipole, Da:	4.41
IP(EA), eV:	-9.32(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[3-(2-fluorophenyl)oxetan-3-yl]cyclopropyl]methanamine

Drug info:

PubChemData

Smile

C1CC1(CN)C2(COC2)C3=CC=CC=N3

DOS

IR

Vibrations