Geometry & MOs

Info

ID:	186891
PubChem CID:	77501387
Reduced:	FO8H21C26 (1)
Stoich.:	AB8C21D26 (1)
Weight, g/mol:	370.200491
ΔH_f, kcal/mol:	-221.49
Dipole, Da:	3.82
IP(EA), eV:	-10.07(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-hydroxy-1-(3-methylbutylamino)-1-oxobutan-2-yl]-6-phenylpyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)OC(=O)C3=CC=CC=C3)OF)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations