Geometry & MOs

Info

ID:	295836
PubChem CID:	117545441
Reduced:	NOC12H17 (1)
Stoich.:	ABC12D17 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	-16.48
Dipole, Da:	2.74
IP(EA), eV:	-9.36(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-tert-butylphenyl)oxetan-3-yl]ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2(COC2)CCN

DOS

IR

Vibrations