Geometry & MOs

Info

ID:	120994
PubChem CID:	50752866
Reduced:	N2O2C13H15 (2)
Stoich.:	A2B2C13D15 (2)
Weight, g/mol:	434.231791
ΔH_f, kcal/mol:	-104.4
Dipole, Da:	1.61
IP(EA), eV:	-8.6(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methoxyphenyl)methyl]-1-(3-propoxyquinoxalin-2-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCOC1=NC2=CC=CC=C2N=C1N3CCCC(C3)C(=O)NC4=CC=CC(=C4)C(=O)OCC

DOS

IR

Vibrations