Geometry & MOs

Info

ID:	297573
PubChem CID:	117622197
Reduced:	O5C25H32 (1)
Stoich.:	A5B25C32 (1)
Weight, g/mol:	671.262119
ΔH_f, kcal/mol:	-205.45
Dipole, Da:	3.55
IP(EA), eV:	-8.64(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[9-(6-aminopyridin-3-yl)-1-[4-(2-cyanopropan-2-yl)phenyl]-2,4-dioxopyrimido[5,4-c][1,5]naphthyridin-3-yl]methyl ditert-butyl phosphate

Drug info:

PubChemData

Smile

CCC1CCC(=CC1C2=C3C(=C(C=C2C)O)CC(C(O3)C4=CC=C(C(C4)O)O)O)C

DOS

IR

Vibrations