Geometry & MOs

Info

ID:	447698
PubChem CID:	135284861
Reduced:	OSF2N2C18H18 (1)
Stoich.:	ABC2D2E18F18 (1)
Weight, g/mol:	374.145285
ΔH_f, kcal/mol:	-88.9
Dipole, Da:	4.5
IP(EA), eV:	-8.49(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-carbazol-9-yl-3-(1,4-dihydro-2,3-benzothiazin-3-yl)propan-2-ol

Drug info:

PubChemData

Smile

C1CN(SC1)CC(CN2C3=C(C=C(C=C3)F)C4=C2C=C(C=C4)F)O

DOS

IR

Vibrations