Geometry & MOs

Info

ID:	351991
PubChem CID:	127282909
Reduced:	OSN3C15H29 (1)
Stoich.:	ABC3D15E29 (1)
Weight, g/mol:	362.243024
ΔH_f, kcal/mol:	-84.94
Dipole, Da:	2.82
IP(EA), eV:	-8.69(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(CCS1)C(=O)NC2CCN(CC2)C(C)(C)C

DOS

IR

Vibrations