Geometry & MOs

Info

ID:	314661
PubChem CID:	126622596
Reduced:	ClNF2O3H14C19 (1)
Stoich.:	ABC2D3E14F19 (1)
Weight, g/mol:	335.95474
ΔH_f, kcal/mol:	-167.31
Dipole, Da:	3.74
IP(EA), eV:	-9.46(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dibromopentan-3-yloxymethylbenzene

Drug info:

PubChemData

Smile

C1[C@H](C(=CC1F)C(=O)O)C(=O)NC2=CC=CC(=C2F)C3=CC=CC=C3Cl

DOS

IR

Vibrations