Geometry & MOs

Info

ID:	357524
PubChem CID:	127294157
Reduced:	O3N5C21H27 (1)
Stoich.:	A3B5C21D27 (1)
Weight, g/mol:	383.232125
ΔH_f, kcal/mol:	-47.31
Dipole, Da:	4.84
IP(EA), eV:	-9.11(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(2-indazol-1-ylacetyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=NOC=N4

DOS

IR

Vibrations