Geometry & MOs

Info

ID:	350950
PubChem CID:	127279260
Reduced:	SO2N3C14H23 (1)
Stoich.:	AB2C3D14E23 (1)
Weight, g/mol:	337.134779
ΔH_f, kcal/mol:	-68.18
Dipole, Da:	5.73
IP(EA), eV:	-9.2(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)pyrrolidine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCCC2C3CCC3

DOS

IR

Vibrations