Geometry & MOs

Info

ID:	284326
PubChem CID:	104043430
Reduced:	O2C6H11 (2)
Stoich.:	A2B6C11 (2)
Weight, g/mol:	303.144613
ΔH_f, kcal/mol:	-211.98
Dipole, Da:	1.54
IP(EA), eV:	-9.55(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,6-dimethyloxan-4-yl)oxy-5-(trifluoromethyl)phenyl]methanamine

Drug info:

PubChemData

Smile

CCOC(=O)CCOC1CC(OC(C1)C)C

DOS

IR

Vibrations