Geometry & MOs

Info

ID:	79343
PubChem CID:	49748155
Reduced:	NSO2C12H15 (2)
Stoich.:	ABC2D12E15 (2)
Weight, g/mol:	500.198108
ΔH_f, kcal/mol:	-129.83
Dipole, Da:	7.44
IP(EA), eV:	-9.17(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(benzenesulfonyl)-1-oxa-4,8-diazaspiro[4.5]decan-8-yl]-[4-(2-methoxyphenyl)oxan-4-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2=CC=CS2)C(=O)N3CCC4(CC3)N(CCO4)S(=O)(=O)C5=CC=CC=C5

DOS

IR

Vibrations