Geometry & MOs

Info

ID:	244612
PubChem CID:	99368233
Reduced:	N3O5C19H21 (1)
Stoich.:	A3B5C19D21 (1)
Weight, g/mol:	405.0688
ΔH_f, kcal/mol:	-135.68
Dipole, Da:	2.74
IP(EA), eV:	-8.88(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(4-bromophenoxy)-N-[2-[methyl(pyridin-3-ylmethyl)amino]-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CN(CC1=CN=CC=C1)C(=O)CNC(=O)C2=CC3=C(C(=C2)OC)OCCO3

DOS

IR

Vibrations