Geometry & MOs

Info

ID:	246532
PubChem CID:	103061157
Reduced:	ON5C11H19 (1)
Stoich.:	AB5C11D19 (1)
Weight, g/mol:	290.199428
ΔH_f, kcal/mol:	14.42
Dipole, Da:	2.71
IP(EA), eV:	-8.86(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methyl-2-phenylpiperazin-1-yl)methyl]oxan-4-ol

Drug info:

PubChemData

Smile

CC1C(CCO1)N(C)CC2=CN=C(C=N2)NN

DOS

IR

Vibrations