Geometry & MOs

Info

ID:	375255
PubChem CID:	131485230
Reduced:	NF2O2C11H11 (1)
Stoich.:	AB2C2D11E11 (1)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	-154.89
Dipole, Da:	4.05
IP(EA), eV:	-9.4(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-dimethyl-3H-1-benzofuran-6-yl)propan-1-amine

Drug info:

PubChemData

Smile

COC(=O)C1CNCC2=C1C=C(C=C2F)F

DOS

IR

Vibrations