Geometry & MOs

Info

ID:	67824
PubChem CID:	46507247
Reduced:	OSN2H4C6 (2)
Stoich.:	ABC2D4E6 (2)
Weight, g/mol:	410.150954
ΔH_f, kcal/mol:	45.99
Dipole, Da:	1.47
IP(EA), eV:	-8.78(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)methyl]-1-(3-methoxyquinoxalin-2-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1=COC(=C1)CN2C(=O)C3=C(C=CS3)N4C2=NNC4=S

DOS

IR

Vibrations