Geometry & MOs

Info

ID:	121199
PubChem CID:	50758334
Reduced:	N4O5C23H28 (1)
Stoich.:	A4B5C23D28 (1)
Weight, g/mol:	365.076018
ΔH_f, kcal/mol:	-161.45
Dipole, Da:	4.94
IP(EA), eV:	-9.26(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]-5H-[1,3]dioxolo[4,5-g]quinazoline-6,8-dione

Drug info:

PubChemData

Smile

CC1(CN2C=NC(=C2C(=O)N1C3=CC(=CC=C3)OC)C(=O)OC)C(=O)NC4CCCCC4

DOS

IR

Vibrations