Geometry & MOs

Info

ID:	423464
PubChem CID:	135119549
Reduced:	FO2N4C16H21 (1)
Stoich.:	AB2C4D16E21 (1)
Weight, g/mol:	305.162708
ΔH_f, kcal/mol:	-47.47
Dipole, Da:	5.47
IP(EA), eV:	-8.98(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1H-inden-5-yloxy)-N-[(3S,4R)-4-hydroxyoxolan-3-yl]-2-methylpropanamide

Drug info:

PubChemData

Smile

CCC1=C(C(=NC=N1)N2C[C@H]([C@H](C2)OC)CC3=CC(=NO3)C)F

DOS

IR

Vibrations