Geometry & MOs

Info

ID:	69144
PubChem CID:	46520144
Reduced:	FN3O4C24H32 (1)
Stoich.:	AB3C4D24E32 (1)
Weight, g/mol:	379.113233
ΔH_f, kcal/mol:	-209.73
Dipole, Da:	2.76
IP(EA), eV:	-9.34(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(2,6-difluorophenyl)-1,3-oxazol-2-yl]-N-isoquinolin-5-ylpropanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NNC(=O)COC1=CC=C(C=C1)F)NC(=O)C23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations