Geometry & MOs

Info

ID:	363773
PubChem CID:	127313413
Reduced:	O3N4C21H28 (1)
Stoich.:	A3B4C21D28 (1)
Weight, g/mol:	319.200825
ΔH_f, kcal/mol:	-112.92
Dipole, Da:	6.13
IP(EA), eV:	-8.79(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-pyrazol-1-ylacetamide

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC4=C(C=C3)NC(=O)CC4

DOS

IR

Vibrations