Geometry & MOs

Info

ID:	363761
PubChem CID:	127313401
Reduced:	O2N5C19H29 (1)
Stoich.:	A2B5C19D29 (1)
Weight, g/mol:	361.247775
ΔH_f, kcal/mol:	-50.81
Dipole, Da:	6.09
IP(EA), eV:	-8.79(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-(3,5-dimethylpyrazol-1-yl)propanamide

Drug info:

PubChemData

Smile

CN(C)C1=C(C=CC=N1)C(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations