Geometry & MOs

Info

ID:	176055
PubChem CID:	75988785
Reduced:	Cl2N4O4C29H34 (1)
Stoich.:	A2B4C4D29E34 (1)
Weight, g/mol:	455.165227
ΔH_f, kcal/mol:	-130.17
Dipole, Da:	5.64
IP(EA), eV:	-9.38(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-azido-5-(2,4-dioxo-1,3-diazinan-1-yl)-3,4-di(propanoyloxy)oxolan-2-yl]methyl propanoate

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)OC(=O)N(C)C2CN(CC2C3=CC(=C(C=C3)Cl)Cl)C(=O)C4CCN(CC4)C(=O)C5(CC5)C

DOS

IR

Vibrations