Geometry & MOs

Info

ID:	420263
PubChem CID:	135112132
Reduced:	SO3N4C16H18 (1)
Stoich.:	AB3C4D16E18 (1)
Weight, g/mol:	335.128821
ΔH_f, kcal/mol:	-62.88
Dipole, Da:	5.87
IP(EA), eV:	-9.44(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloro-2-methoxyphenyl)-(4-methyl-1-oxa-9-azaspiro[5.5]undec-4-en-9-yl)methanone

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)C2=CC=CS2)C(=O)CN3C=CC=NC3=O

DOS

IR

Vibrations