Geometry & MOs

Info

ID:	45349
PubChem CID:	10511733
Reduced:	NSO2C8H11 (1)
Stoich.:	ABC2D8E11 (1)
Weight, g/mol:	186.046299
ΔH_f, kcal/mol:	-28.92
Dipole, Da:	3.08
IP(EA), eV:	-9.11(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N,3-trimethyl-5-oxo-1,2-oxazole-2-carbothioamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(=O)N(C)OC

DOS

IR

Vibrations