Geometry & MOs

Info

ID:	382714
PubChem CID:	134974033
Reduced:	N4O4H20C21 (1)
Stoich.:	A4B4C20D21 (1)
Weight, g/mol:	674.260131
ΔH_f, kcal/mol:	-78.84
Dipole, Da:	8.87
IP(EA), eV:	-8.8(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-(2-methoxyethyl)-3-[4-[10-(2-methoxyethyl)-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-3-yl]phenyl]-7,8-dimethylbenzo[g]pteridine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)N(C3=NC(=O)N(C(=O)C3=N2)C4=CC=C(C=C4)O)CCOC

DOS

IR

Vibrations