Geometry & MOs

Info

ID:	436032
PubChem CID:	135193438
Reduced:	ON2C22H32 (1)
Stoich.:	AB2C22D32 (1)
Weight, g/mol:	269.101171
ΔH_f, kcal/mol:	5.58
Dipole, Da:	4.19
IP(EA), eV:	-8.56(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(4R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide

Drug info:

PubChemData

Smile

CC/C=C\C(=C)/C(=C\1/C=CC=CC1C)/CNCCCNC(=O)C(=C)C

DOS

IR

Vibrations