Geometry & MOs

Info

ID:	357215
PubChem CID:	127293719
Reduced:	SO2N3C21H29 (1)
Stoich.:	AB2C3D21E29 (1)
Weight, g/mol:	389.213698
ΔH_f, kcal/mol:	-66.79
Dipole, Da:	3.22
IP(EA), eV:	-8.69(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-tert-butylpiperidin-4-yl)-4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxobutanamide

Drug info:

PubChemData

Smile

C1CC1CN2CCC(CC2)NC(=O)CCC(=O)N3CCSC4=CC=CC=C43

DOS

IR

Vibrations