Geometry & MOs

Info

ID:	280624
PubChem CID:	103850342
Reduced:	NO4C11H21 (1)
Stoich.:	AB4C11D21 (1)
Weight, g/mol:	257.083413
ΔH_f, kcal/mol:	-199.07
Dipole, Da:	4.68
IP(EA), eV:	-9.64(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]propane-1-sulfonamide

Drug info:

PubChemData

Smile

CC(CCOC)(CNC(=O)[C@H]1CCCO1)O

DOS

IR

Vibrations