Geometry & MOs

Info

ID:	370947
PubChem CID:	127341496
Reduced:	N3O3S3C13H23 (1)
Stoich.:	A3B3C3D13E23 (1)
Weight, g/mol:	381.183461
ΔH_f, kcal/mol:	-97.98
Dipole, Da:	2.82
IP(EA), eV:	-8.69(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[[cyclopropylmethyl(methyl)sulfamoyl]amino]propanoyl]-4-pyridin-2-ylpiperazine

Drug info:

PubChemData

Smile

CN(CC1CC1)S(=O)(=O)N2CSCC2C(=O)N3CCSCC3

DOS

IR

Vibrations