Geometry & MOs

Info

ID:	76212
PubChem CID:	48424600
Reduced:	N2O4C13H24 (1)
Stoich.:	A2B4C13D24 (1)
Weight, g/mol:	329.04267
ΔH_f, kcal/mol:	-175.67
Dipole, Da:	5.28
IP(EA), eV:	-9.37(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-bromo-4-fluorophenyl)methyl]-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCCC(=O)NCCOC)OCC1CC1

DOS

IR

Vibrations