Geometry & MOs

Info

ID:	367727
PubChem CID:	127325687
Reduced:	SO2N4C19H28 (1)
Stoich.:	AB2C4D19E28 (1)
Weight, g/mol:	374.177647
ΔH_f, kcal/mol:	-75.49
Dipole, Da:	5.57
IP(EA), eV:	-8.54(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,4-dimethyl-N-[(1-methylpiperidin-3-yl)methyl]-2-oxo-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-triene-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)N(C)CC3CCCN(C3)C)C

DOS

IR

Vibrations