Geometry & MOs

Info

ID:	365161
PubChem CID:	127316965
Reduced:	N6C19H22 (1)
Stoich.:	A6B19C22 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	114.55
Dipole, Da:	3.04
IP(EA), eV:	-8.63(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[6-(3-methyl-3-phenylpiperidin-1-yl)pyrimidin-4-yl]pyrrolidin-2-yl]methanol

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)C3=NC=NC4=C3C=NN4C5=CC=CC=C5

DOS

IR

Vibrations