Geometry & MOs

Info

ID:	7336
PubChem CID:	72184
Reduced:	O5N6C17H20 (1)
Stoich.:	A5B6C17D20 (1)
Weight, g/mol:	388.149518
ΔH_f, kcal/mol:	-112.14
Dipole, Da:	6.53
IP(EA), eV:	-8.57(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl 1-methyl-4H-pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COC(=O)C3=CN(C=CC3)C)N=[N+]=[N-]

DOS

IR

Vibrations