Geometry & MOs

Info

ID:	351982
PubChem CID:	127282900
Reduced:	O3N4C16H28 (1)
Stoich.:	A3B4C16D28 (1)
Weight, g/mol:	376.258674
ΔH_f, kcal/mol:	-126.39
Dipole, Da:	4.68
IP(EA), eV:	-9.31(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(cyclopentylamino)-1-oxopropan-2-yl]-N-[2-(1-methylpyrazol-4-yl)ethyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CC1)N2CCN(CC2)C(=O)NC3CCOCC3

DOS

IR

Vibrations