Geometry & MOs

Info

ID:	207100
PubChem CID:	80346396
Reduced:	ClN2O2C11H13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	261.097663
ΔH_f, kcal/mol:	-63.22
Dipole, Da:	0.71
IP(EA), eV:	-8.63(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(trifluoromethoxy)phenyl]methyl]oxolan-3-amine

Drug info:

PubChemData

Smile

COC(=O)C1CCN(C1)C2=C(C=CC=N2)Cl

DOS

IR

Vibrations