Geometry & MOs

Info

ID:	440075
PubChem CID:	135229960
Reduced:	IN3C8H10 (1)
Stoich.:	AB3C8D10 (1)
Weight, g/mol:	249.147727
ΔH_f, kcal/mol:	56.68
Dipole, Da:	1.97
IP(EA), eV:	-9.3(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(hydroxymethyl)-2-(4-phenylpiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

C1CNCC1C2=NC=C(C=N2)I

DOS

IR

Vibrations