Geometry & MOs

Info

ID:	76109
PubChem CID:	48424444
Reduced:	BrFN2O3C18H18 (1)
Stoich.:	ABC2D3E18F18 (1)
Weight, g/mol:	308.190006
ΔH_f, kcal/mol:	-137.79
Dipole, Da:	3.41
IP(EA), eV:	-9.73(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[3-(2-fluoro-N-methylanilino)propyl]propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCC2=CC(=CC(=C2)Br)F

DOS

IR

Vibrations