Geometry & MOs

Info

ID:	148070
PubChem CID:	53787732
Reduced:	O3N4H26C27 (1)
Stoich.:	A3B4C26D27 (1)
Weight, g/mol:	273.076099
ΔH_f, kcal/mol:	10.08
Dipole, Da:	3.35
IP(EA), eV:	-9.3(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro-2-oxopyrimidin-4-yl]formamide

Drug info:

PubChemData

Smile

CC(C(CC1=CC(=CC=C1)C(=N)N)C(=O)OC)NC(=O)C2=CN=C(C=C2)C#CC3=CC=CC=C3

DOS

IR

Vibrations