Geometry & MOs

Info

ID:	75651
PubChem CID:	48423799
Reduced:	BrO2N3C16H22 (1)
Stoich.:	AB2C3D16E22 (1)
Weight, g/mol:	329.094934
ΔH_f, kcal/mol:	-38.76
Dipole, Da:	0.87
IP(EA), eV:	-8.76(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[1-(2,4-dichlorophenyl)ethyl]-N-methylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)C2=NC=C(C=C2)Br)OCC3CC3

DOS

IR

Vibrations