Geometry & MOs

Info

ID:	236324
PubChem CID:	92712346
Reduced:	O3N4C19H22 (1)
Stoich.:	A3B4C19D22 (1)
Weight, g/mol:	332.094312
ΔH_f, kcal/mol:	-40.16
Dipole, Da:	7.49
IP(EA), eV:	-9.68(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC[C@H](C(=O)N(CC)CC1=CC=CC=C1)N2C=NC3=C(C2=O)C(=NO3)C

DOS

IR

Vibrations