Geometry & MOs

Info

ID:	233992
PubChem CID:	92297486
Reduced:	SN4O5C18H32 (1)
Stoich.:	AB4C5D18E32 (1)
Weight, g/mol:	416.209341
ΔH_f, kcal/mol:	-231.71
Dipole, Da:	4.52
IP(EA), eV:	-9.13(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(3R)-3-(cyclopentylcarbamoyl)piperidin-1-yl]sulfonylpiperazine-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)N1CCN(CC1)S(=O)(=O)N2CCC[C@H](C2)C(=O)N3CCCCC3

DOS

IR

Vibrations