Geometry & MOs

Info

ID:	327554
PubChem CID:	126690322
Reduced:	NSC5H8 (2)
Stoich.:	ABC5D8 (2)
Weight, g/mol:	643.267584
ΔH_f, kcal/mol:	25.55
Dipole, Da:	2.4
IP(EA), eV:	-7.87(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-[2-(1-butyl-5-cyano-6-hydroxy-4-methyl-2-oxopyridin-3-yl)hydrazinyl]phenyl]sulfonyl-[2-(2-methylprop-2-enoyloxy)propyl]amino]propan-2-yl 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CCC\1C(=CS/C1=C(/N=C\N)\SC)C

DOS

IR

Vibrations