Geometry & MOs

Info

ID:	236322
PubChem CID:	92712344
Reduced:	O3N4C16H22 (1)
Stoich.:	A3B4C16D22 (1)
Weight, g/mol:	354.169191
ΔH_f, kcal/mol:	-75.5
Dipole, Da:	8.68
IP(EA), eV:	-9.78(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC[C@H](C(=O)N1CCC(CC1)C)N2C=NC3=C(C2=O)C(=NO3)C

DOS

IR

Vibrations