Geometry & MOs

Info

ID:	357990
PubChem CID:	127295504
Reduced:	ON5C22H31 (1)
Stoich.:	AB5C22D31 (1)
Weight, g/mol:	252.220164
ΔH_f, kcal/mol:	2.39
Dipole, Da:	3.73
IP(EA), eV:	-8.43(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(oxan-2-ylmethyl)pyrrolidin-3-yl]piperidine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CN3CCC(C3)N4CCCCC4

DOS

IR

Vibrations