Geometry & MOs

Info

ID:	236328
PubChem CID:	92712350
Reduced:	N2O2C9H10 (2)
Stoich.:	A2B2C9D10 (2)
Weight, g/mol:	326.13789
ΔH_f, kcal/mol:	-72.49
Dipole, Da:	2.87
IP(EA), eV:	-9.04(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-benzyl-2-(3-methyl-4-oxo-[1,2]oxazolo[5,4-d]pyrimidin-5-yl)butanamide

Drug info:

PubChemData

Smile

CC[C@H](C(=O)NCC1=CC(=CC=C1)OC)N2C=NC3=C(C2=O)C(=NO3)C

DOS

IR

Vibrations