Geometry & MOs

Info

ID:	260914
PubChem CID:	103209456
Reduced:	F2N2O2C11H22 (1)
Stoich.:	A2B2C2D11E22 (1)
Weight, g/mol:	284.133634
ΔH_f, kcal/mol:	-218.5
Dipole, Da:	4.81
IP(EA), eV:	-9.54(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)propanamide

Drug info:

PubChemData

Smile

CCC(CC)(CN)NC(=O)CCOCC(F)F

DOS

IR

Vibrations