Geometry & MOs

Info

ID:	257998
PubChem CID:	103149808
Reduced:	ClNOF3C15H21 (1)
Stoich.:	ABCD3E15F21 (1)
Weight, g/mol:	367.07586
ΔH_f, kcal/mol:	-204.42
Dipole, Da:	1.43
IP(EA), eV:	-9.04(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-3-fluorophenyl)-4-(2,2-difluoroethoxy)-N-propylbutan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CCOCC(F)F)CC1=C(C=C(C=C1)F)Cl

DOS

IR

Vibrations