Geometry & MOs

Info

ID:	140767
PubChem CID:	52755751
Reduced:	N3O3H19C22 (1)
Stoich.:	A3B3C19D22 (1)
Weight, g/mol:	422.124464
ΔH_f, kcal/mol:	-31.29
Dipole, Da:	2.08
IP(EA), eV:	-8.75(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-[[(2R)-3-(2,6-dimethoxyphenoxy)-2-hydroxypropyl]amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

C1[C@H](CN(C1=O)C2=CC=C(C=C2)OC3=CC=CC=C3)NC(=O)C4=CC=NC=C4

DOS

IR

Vibrations