Geometry & MOs

Info

ID:	179339
PubChem CID:	76468781
Reduced:	FON5C20H20 (1)
Stoich.:	ABC5D20E20 (1)
Weight, g/mol:	474.101621
ΔH_f, kcal/mol:	28.93
Dipole, Da:	9.11
IP(EA), eV:	-9.12(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)-6-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]-5,7a-dihydro-3aH-[1,3]thiazolo[5,4-e][1,3]oxazin-7-one

Drug info:

PubChemData

Smile

C1CC(N(C1)C2=NN3C(=NC=C3C(=O)NC4CC4)C=C2)C5=CC(=CC=C5)F

DOS

IR

Vibrations