Geometry & MOs

Info

ID:	344785
PubChem CID:	127268406
Reduced:	SN3O4C14H23 (1)
Stoich.:	AB3C4D14E23 (1)
Weight, g/mol:	379.120192
ΔH_f, kcal/mol:	-118.25
Dipole, Da:	3.16
IP(EA), eV:	-9.22(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-(2,3-dihydro-1,4-benzodioxin-5-ylsulfonyl)piperazin-1-yl]methyl]-3-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CN2CCN(CC2)S(=O)(=O)CC3CCCO3

DOS

IR

Vibrations