Geometry & MOs

Info

ID:	231862
PubChem CID:	87574810
Reduced:	OC27H56 (1)
Stoich.:	AB27C56 (1)
Weight, g/mol:	337.142641
ΔH_f, kcal/mol:	-151.36
Dipole, Da:	0.69
IP(EA), eV:	-9.6(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methyl-2-oxo-1H-pyridin-3-yl)amino]-4-[[(1R)-1-phenylpropyl]amino]cyclobut-3-ene-1,2-dione

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCOCCCCCCCCCC.CC=C

DOS

IR

Vibrations