Geometry & MOs

Info

ID:	79350
PubChem CID:	49748184
Reduced:	ClSN2O6C26H31 (1)
Stoich.:	ABC2D6E26F31 (1)
Weight, g/mol:	466.078777
ΔH_f, kcal/mol:	-212.9
Dipole, Da:	8.07
IP(EA), eV:	-9.06(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-chlorophenyl)sulfonyl-1-oxa-4,8-diazaspiro[4.5]decan-8-yl]-(1-thiophen-2-ylcyclopropyl)methanone

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2(CCOCC2)C(=O)N3CCC4(CC3)N(CCO4)S(=O)(=O)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations