Geometry & MOs

Info

ID:	136775
PubChem CID:	52098765
Reduced:	N3O7H23C25 (1)
Stoich.:	A3B7C23D25 (1)
Weight, g/mol:	477.1536
ΔH_f, kcal/mol:	-159.79
Dipole, Da:	4.18
IP(EA), eV:	-8.87(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 4-methoxy-3-[[(2S)-2-phenoxypropanoyl]amino]benzoate

Drug info:

PubChemData

Smile

CC1=CC2=NC(=CC(=O)N2O1)COC(=O)C3=CC(=C(C=C3)OC)NC(=O)[C@@H](C)OC4=CC=CC=C4

DOS

IR

Vibrations