Geometry & MOs

Info

ID:	190678
PubChem CID:	78041058
Reduced:	O3N7C20H25 (1)
Stoich.:	A3B7C20D25 (1)
Weight, g/mol:	377.138699
ΔH_f, kcal/mol:	-35.85
Dipole, Da:	5.77
IP(EA), eV:	-8.96(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[3-fluoro-4-hydroxy-5-(1-hydroxyethyl)-3-methyloxolan-2-yl]-2-oxopyrimidin-4-yl]benzamide

Drug info:

PubChemData

Smile

COC1=NC=CC(=C1)C2=CC(=C3N2N=CN=C3N)C(=O)NC4CCCN(C4)CCO

DOS

IR

Vibrations