Geometry & MOs

Info

ID:	1096
PubChem CID:	3781
Reduced:	SN3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	285.129969
ΔH_f, kcal/mol:	59.01
Dipole, Da:	1.14
IP(EA), eV:	-7.72(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1-pyrido[3,2-b][1,4]benzothiazin-10-ylpropan-2-amine

Drug info:

PubChemData

Smile

CC(CN1C2=CC=CC=C2SC3=C1N=CC=C3)N(C)C

DOS

IR

Vibrations