Geometry & MOs

Info

ID:	281460
PubChem CID:	103913906
Reduced:	SN2O4C16H32 (1)
Stoich.:	AB2C4D16E32 (1)
Weight, g/mol:	349.203528
ΔH_f, kcal/mol:	-199.72
Dipole, Da:	6.25
IP(EA), eV:	-9.19(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[2-(1-methylsulfonylpropan-2-ylamino)ethyl]piperazine-1-carboxylate

Drug info:

PubChemData

Smile

CCS(=O)(=O)CC(C)NCCCN(C1CC1)C(=O)OC(C)(C)C

DOS

IR

Vibrations