Geometry & MOs

Info

ID:	423698
PubChem CID:	135120043
Reduced:	S2O5N8C37H50 (1)
Stoich.:	A2B5C8D37E50 (1)
Weight, g/mol:	303.088892
ΔH_f, kcal/mol:	-168.4
Dipole, Da:	1.45
IP(EA), eV:	-8.72(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@H]1C(=O)N[C@H](C(=O)N[C@H](CN(CC(=O)N[C@H](C2=NC(=CS2)C(=O)N[C@@H](C(=O)N1)C)C(C)C)CC3=CC=CC=N3)CC4=CC=CC=C4)CCSC

DOS

IR

Vibrations