Geometry & MOs

Info

ID:	67520
PubChem CID:	46506633
Reduced:	S2N4O5C28H28 (1)
Stoich.:	A2B4C5D28E28 (1)
Weight, g/mol:	311.008614
ΔH_f, kcal/mol:	-127.52
Dipole, Da:	5.26
IP(EA), eV:	-8.3(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-fluorophenyl)methyl]-2,2-dioxothieno[3,2-c]thiazin-4-one

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CN(CC4)C(=O)C)C(=O)N2C5=CC(=CC=C5)OC

DOS

IR

Vibrations