Geometry & MOs

Info

ID:	363815
PubChem CID:	127313472
Reduced:	ClO2N3C21H28 (1)
Stoich.:	AB2C3D21E28 (1)
Weight, g/mol:	346.200491
ΔH_f, kcal/mol:	-57.85
Dipole, Da:	4.61
IP(EA), eV:	-8.75(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-methoxypyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CCN(CC2)CCNC(=O)C3CC3C4=CC(=CC=C4)Cl

DOS

IR

Vibrations