Geometry & MOs

Info

ID:	287358
PubChem CID:	104239162
Reduced:	ClNO3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	299.128821
ΔH_f, kcal/mol:	-111.0
Dipole, Da:	2.72
IP(EA), eV:	-9.23(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-chloro-4-[(1S)-1-hydroxyethyl]phenoxy]-N,N-diethylpropanamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=C(C=C1)OC(C)C(=O)NCC=C)Cl)O

DOS

IR

Vibrations