Geometry & MOs

Info

ID:	435146
PubChem CID:	135181989
Reduced:	ON2C14H30 (1)
Stoich.:	AB2C14D30 (1)
Weight, g/mol:	431.179124
ΔH_f, kcal/mol:	-71.28
Dipole, Da:	2.15
IP(EA), eV:	-8.36(2.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(Z)-1-(6-tert-butyl-5-fluoropyridin-3-yl)-2-cyano-3-oxoprop-1-enyl]imino-3-methyl-1,3-thiazinan-5-yl]methyl]acetamide

Drug info:

PubChemData

Smile

CCOCCCN(C)CCCN1CCCCC1

DOS

IR

Vibrations