Geometry & MOs

Info

ID:	439461
PubChem CID:	135229235
Reduced:	OH22C24 (1)
Stoich.:	AB22C24 (1)
Weight, g/mol:	508.181881
ΔH_f, kcal/mol:	50.24
Dipole, Da:	1.63
IP(EA), eV:	-8.7(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dioxopyrrolidin-1-yl) (4R)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanoate

Drug info:

PubChemData

Smile

C/C=C/C1=CC=CC=C1OC2=CC=C(C=C2)/C(=C/C)/C3=CC=CC=C3

DOS

IR

Vibrations