Geometry & MOs

Info

ID:	363789
PubChem CID:	127313436
Reduced:	O3N5C17H25 (1)
Stoich.:	A3B5C17D25 (1)
Weight, g/mol:	330.205576
ΔH_f, kcal/mol:	-81.83
Dipole, Da:	2.22
IP(EA), eV:	-8.87(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C(=O)C=CC(=N1)C(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations