Geometry & MOs

Info

ID:	280474
PubChem CID:	103849451
Reduced:	N2F3O3C12H13 (1)
Stoich.:	A2B3C3D12E13 (1)
Weight, g/mol:	339.04701
ΔH_f, kcal/mol:	-259.96
Dipole, Da:	6.36
IP(EA), eV:	-10.1(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1COCC1(CNC(=O)C2=CN=C(C=C2)C(F)(F)F)O

DOS

IR

Vibrations