Geometry & MOs

Info

ID:	358016
PubChem CID:	127295530
Reduced:	ON2C9H16 (2)
Stoich.:	AB2C9D16 (2)
Weight, g/mol:	386.268176
ΔH_f, kcal/mol:	-115.58
Dipole, Da:	5.49
IP(EA), eV:	-8.34(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-hydroxyphenyl)piperazin-1-yl]-2-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCC(CC1)C(=O)N)N2CCC(C2)N3CCCCC3

DOS

IR

Vibrations