Geometry & MOs

Info

ID:	418638
PubChem CID:	135106488
Reduced:	N2O3C25H30 (1)
Stoich.:	A2B3C25D30 (1)
Weight, g/mol:	375.047812
ΔH_f, kcal/mol:	-85.94
Dipole, Da:	5.89
IP(EA), eV:	-8.72(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S,4S)-4-[(6-chloro-1,3-benzothiazol-2-yl)amino]oxolan-3-yl]-N,N-dimethylmethanesulfonamide

Drug info:

PubChemData

Smile

C1C[C@@H]2CN(C[C@@H]2[C@](C1)(C3=CC=CC=C3)O)C(=O)CN4CCOC5=CC=CC=C5C4

DOS

IR

Vibrations