Geometry & MOs

Info

ID:	280539
PubChem CID:	103849808
Reduced:	NSO5C9H17 (1)
Stoich.:	ABC5D9E17 (1)
Weight, g/mol:	271.061136
ΔH_f, kcal/mol:	-232.47
Dipole, Da:	10.33
IP(EA), eV:	-9.61(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CCC(=O)NCC1(CCOC1)O

DOS

IR

Vibrations