Geometry & MOs

Info

ID:	257997
PubChem CID:	103149807
Reduced:	NOF2C11H21 (1)
Stoich.:	ABC2D11E21 (1)
Weight, g/mol:	323.126376
ΔH_f, kcal/mol:	-155.77
Dipole, Da:	2.38
IP(EA), eV:	-9.1(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-4-fluorophenyl)-4-(2,2-difluoroethoxy)-N-propylbutan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CCOCC(F)F)CC=C

DOS

IR

Vibrations