Geometry & MOs

Info

ID:	350807
PubChem CID:	127279095
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	367.237211
ΔH_f, kcal/mol:	-54.34
Dipole, Da:	4.61
IP(EA), eV:	-8.69(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylcyclohexyl)-2-(4-quinoxalin-2-ylpiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC(=O)CN2CCN(CC2)C3=NC4=CC=CC=C4O3

DOS

IR

Vibrations