Geometry & MOs

Info

ID:	79342
PubChem CID:	49748154
Reduced:	SN3O6C25H27 (1)
Stoich.:	AB3C6D25E27 (1)
Weight, g/mol:	474.1647
ΔH_f, kcal/mol:	-195.95
Dipole, Da:	8.33
IP(EA), eV:	-9.52(-1.75)
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]-(1-thiophen-2-ylcyclohexyl)methanone

Drug info:

PubChemData

Smile

C1CN(CCC12N(CCO2)S(=O)(=O)C3=CC=CC=C3)C(=O)CCCN4C(=O)C5=CC=CC=C5C4=O

DOS

IR

Vibrations