Geometry & MOs

Info

ID:	436580
PubChem CID:	135205620
Reduced:	OSN4C13H18 (1)
Stoich.:	ABC4D13E18 (1)
Weight, g/mol:	460.1765
ΔH_f, kcal/mol:	10.66
Dipole, Da:	5.59
IP(EA), eV:	-8.69(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[4-[5-chloro-2-(4,5-dihydro-1,2-oxazol-3-yl)phenyl]-5-methoxy-2-oxopyridin-1-yl]pentanoate

Drug info:

PubChemData

Smile

CC(C)C1=CSC(=N1)N(C)C(=O)C2CCCN2C#N

DOS

IR

Vibrations