Geometry & MOs

Info

ID:	205904
PubChem CID:	80174862
Reduced:	NOF3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-206.08
Dipole, Da:	3.85
IP(EA), eV:	-9.53(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,4-dimethylphenyl)-(2-methyloxolan-2-yl)methanamine

Drug info:

PubChemData

Smile

CC1(CCCO1)C(CC2=CC(=CC=C2)C(F)(F)F)N

DOS

IR

Vibrations