Geometry & MOs

Info

ID:	333456
PubChem CID:	127252008
Reduced:	ON6C22H30 (1)
Stoich.:	AB6C22D30 (1)
Weight, g/mol:	410.221895
ΔH_f, kcal/mol:	17.99
Dipole, Da:	5.11
IP(EA), eV:	-8.77(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-N-[5-[1-(quinoxalin-6-ylmethyl)piperidin-2-yl]pyridin-2-yl]pyridin-2-amine

Drug info:

PubChemData

Smile

C1CCCN(CC1)CC(=O)N2CCCCC2C3=CN=C(C=C3)NC4=NC=CN=C4

DOS

IR

Vibrations