Geometry & MOs

Info

ID:	351461
PubChem CID:	127280349
Reduced:	O2N5C22H33 (1)
Stoich.:	A2B5C22D33 (1)
Weight, g/mol:	371.232125
ΔH_f, kcal/mol:	-72.96
Dipole, Da:	7.41
IP(EA), eV:	-8.71(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pyrrolidin-1-yl-1-[4-(6-pyrrolidin-1-ylpyridine-3-carbonyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=NC=C(C=C2)C(=O)N3CCN(CC3)C(=O)CN4CCCC4

DOS

IR

Vibrations