Geometry & MOs

Info

ID:	145248
PubChem CID:	53487612
Reduced:	NCl2O3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	283.097521
ΔH_f, kcal/mol:	-158.47
Dipole, Da:	7.69
IP(EA), eV:	-9.73(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-4-morpholin-4-ylbutanoic acid

Drug info:

PubChemData

Smile

C1COCCN1CCC(C2=CC(=CC=C2)Cl)C(=O)O.Cl

DOS

IR

Vibrations