Geometry & MOs

Info

ID:	295999
PubChem CID:	117549686
Reduced:	ON2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	231.162314
ΔH_f, kcal/mol:	24.51
Dipole, Da:	4.12
IP(EA), eV:	-8.93(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[1-[3-(3-methylphenyl)oxetan-3-yl]cyclopropyl]methanamine

Drug info:

PubChemData

Smile

CNCC1(CC1)C2(COC2)C3=CC=CC=N3

DOS

IR

Vibrations