Geometry & MOs

Info

ID:	257856
PubChem CID:	103148835
Reduced:	NF2O3C13H23 (1)
Stoich.:	AB2C3D13E23 (1)
Weight, g/mol:	325.02891
ΔH_f, kcal/mol:	-251.75
Dipole, Da:	3.16
IP(EA), eV:	-9.63(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COC2(CCOC2)CC1C(CCOCC(F)F)N

DOS

IR

Vibrations