Geometry & MOs

Info

ID:	307442
PubChem CID:	125299953
Reduced:	N2O3C13H16 (1)
Stoich.:	A2B3C13D16 (1)
Weight, g/mol:	337.109627
ΔH_f, kcal/mol:	-69.5
Dipole, Da:	1.75
IP(EA), eV:	-8.81(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-4-methyl-2,6-dioxo-N-[(2S)-4-phenylbutan-2-yl]-5H-pyrimidine-5-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC2=NCC(=C2C=C1)C[C@H](C(=O)OC)N

DOS

IR

Vibrations