Geometry & MOs

Info

ID:	403765
PubChem CID:	135061777
Reduced:	NSO4C15H21 (1)
Stoich.:	ABC4D15E21 (1)
Weight, g/mol:	514.93435
ΔH_f, kcal/mol:	-159.24
Dipole, Da:	3.69
IP(EA), eV:	-9.51(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,5R)-3-azido-4-hydroxy-5-(hydroxymethyl)selenolan-2-yl]-3-benzoyl-5-bromopyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC(=O)C1CCCN(CC1)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations