Geometry & MOs

Info

ID:	193167
PubChem CID:	78352454
Reduced:	FSN5O5C24H28 (1)
Stoich.:	ABC5D5E24F28 (1)
Weight, g/mol:	412.109293
ΔH_f, kcal/mol:	-186.52
Dipole, Da:	6.35
IP(EA), eV:	-8.07(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-1-(furan-2-yl)-4a,5,6,7,8,8a-hexahydro-1H-chromeno[2,3-c]pyrrole-3,9-dione

Drug info:

PubChemData

Smile

CN1C2C(C(NC(N2)C3=CC=C(C=C3)F)SCC(=O)NC4=C(C=C(C=C4)OC)OC)C(=O)N(C1=O)C

DOS

IR

Vibrations