Geometry & MOs

Info

ID:	358362
PubChem CID:	127295907
Reduced:	SO2N3C16H23 (1)
Stoich.:	AB2C3D16E23 (1)
Weight, g/mol:	371.220892
ΔH_f, kcal/mol:	-65.5
Dipole, Da:	3.29
IP(EA), eV:	-8.79(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-hydroxybenzoyl)pyrrolidin-2-yl]-(3-piperidin-1-ylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)CNC(=O)C3=CSC=C3

DOS

IR

Vibrations