Geometry & MOs

Info

ID:	363780
PubChem CID:	127313420
Reduced:	SO2N3C17H25 (1)
Stoich.:	AB2C3D17E25 (1)
Weight, g/mol:	380.221226
ΔH_f, kcal/mol:	-61.74
Dipole, Da:	5.75
IP(EA), eV:	-8.63(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-methylquinoline-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CCN(CC2)CCNC(=O)CC3=CC=CS3

DOS

IR

Vibrations