Geometry & MOs

Info

ID:	183653
PubChem CID:	77048674
Reduced:	ClO2N3C14H18 (1)
Stoich.:	AB2C3D14E18 (1)
Weight, g/mol:	262.017891
ΔH_f, kcal/mol:	-27.15
Dipole, Da:	3.65
IP(EA), eV:	-9.36(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-3-pyrrolidin-1-ylsulfonyl-3H-pyridin-6-one

Drug info:

PubChemData

Smile

CC(CCOC)NCC1=NC(=O)C2C=CC(=CC2=N1)Cl

DOS

IR

Vibrations