Geometry & MOs

Info

ID:	351509
PubChem CID:	127280397
Reduced:	SO2N4C18H26 (1)
Stoich.:	AB2C4D18E26 (1)
Weight, g/mol:	364.247441
ΔH_f, kcal/mol:	-61.08
Dipole, Da:	6.52
IP(EA), eV:	-9.1(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[4-(2-pyrrolidin-1-ylacetyl)piperazine-1-carbonyl]piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

C1CCN(C1)CC(=O)N2CCN(CC2)C(=O)CSCC3=CC=NC=C3

DOS

IR

Vibrations