Geometry & MOs

Info

ID:	248370
PubChem CID:	103081093
Reduced:	ClO2N3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	301.14895
ΔH_f, kcal/mol:	-15.45
Dipole, Da:	6.52
IP(EA), eV:	-8.9(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-difluoroethoxy)-N-[(5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C)CNC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations