Geometry & MOs

Info

ID:	196261
PubChem CID:	78803204
Reduced:	ClO3N4H15C18 (1)
Stoich.:	AB3C4D15E18 (1)
Weight, g/mol:	314.130028
ΔH_f, kcal/mol:	-14.71
Dipole, Da:	3.99
IP(EA), eV:	-8.68(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-hydroxypropyl)propanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NNC(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations