Geometry & MOs

Info

ID:	344837
PubChem CID:	127268477
Reduced:	NS2O5C16H21 (1)
Stoich.:	AB2C5D16E21 (1)
Weight, g/mol:	331.054815
ΔH_f, kcal/mol:	-173.05
Dipole, Da:	7.66
IP(EA), eV:	-9.28(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1,4-benzoxazin-4-ylsulfonyl)thiane 1,1-dioxide

Drug info:

PubChemData

Smile

CC(C1=CC2=CC=CC=C2O1)N(C)S(=O)(=O)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations