Geometry & MOs

Info

ID:	441024
PubChem CID:	135232755
Reduced:	ON3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	178.020084
ΔH_f, kcal/mol:	-29.31
Dipole, Da:	4.53
IP(EA), eV:	-8.99(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6Z)-6-(2H-1,2-oxazol-5-ylidene)pyridine-3-thione

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)NC(=O)CNC2CCCCC2

DOS

IR

Vibrations