Geometry & MOs

Info

ID:	425675
PubChem CID:	135127311
Reduced:	NO5C41H79 (1)
Stoich.:	AB5C41D79 (1)
Weight, g/mol:	437.139842
ΔH_f, kcal/mol:	-396.41
Dipole, Da:	4.62
IP(EA), eV:	-10.04(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(4S)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]-2,2-dimethyl-3H-1-benzofuran-6-carboxamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)OCC(C(=O)NCC)OC(=O)CCCCCCCCCCCCCCCCC

DOS

IR

Vibrations