Geometry & MOs

Info

ID:	421342
PubChem CID:	135115805
Reduced:	NO2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	331.120192
ΔH_f, kcal/mol:	-82.0
Dipole, Da:	2.26
IP(EA), eV:	-8.71(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-5-ethyl-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CN(CCOCC1=CC=CC=C1)C2C[C@@H]3CC(C[C@@H]3C2)O

DOS

IR

Vibrations