Geometry & MOs

Info

ID:	425507
PubChem CID:	135126578
Reduced:	ClNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	346.119654
ΔH_f, kcal/mol:	-86.13
Dipole, Da:	4.42
IP(EA), eV:	-8.21(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(5-hydroxypyridin-2-yl)acetamide

Drug info:

PubChemData

Smile

COC(=O)CC1CCN(CC1)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations