Geometry & MOs

Info

ID:	74671
PubChem CID:	48422271
Reduced:	NCl2O2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	339.08339
ΔH_f, kcal/mol:	-81.06
Dipole, Da:	3.28
IP(EA), eV:	-9.46(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-bromophenyl)propyl]-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCCC1=C(C=C(C=C1)Cl)Cl)OCC2CC2

DOS

IR

Vibrations