Geometry & MOs

Info

ID:	258850
PubChem CID:	103157234
Reduced:	BrClNOC14H19 (1)
Stoich.:	ABCDE14F19 (1)
Weight, g/mol:	333.05398
ΔH_f, kcal/mol:	-54.52
Dipole, Da:	2.84
IP(EA), eV:	-8.65(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-4,6-difluoroanilino)-3-cyclopentylpropan-2-ol

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CNC2=C(C=C(C=C2)Br)Cl)O

DOS

IR

Vibrations