Geometry & MOs

Info

ID:	351469
PubChem CID:	127280357
Reduced:	O3N4C19H32 (1)
Stoich.:	A3B4C19D32 (1)
Weight, g/mol:	364.247441
ΔH_f, kcal/mol:	-148.74
Dipole, Da:	8.66
IP(EA), eV:	-9.21(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC(=O)N1CCCC1C(=O)N2CCN(CC2)C(=O)CN3CCCC3

DOS

IR

Vibrations