Geometry & MOs

Info

ID:	336374
PubChem CID:	127255381
Reduced:	ClS2N3C9H18 (1)
Stoich.:	AB2C3D9E18 (1)
Weight, g/mol:	327.231063
ΔH_f, kcal/mol:	-3.75
Dipole, Da:	2.63
IP(EA), eV:	-8.66(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-benzyl-1-cyclohexyl-1,3,8-triazaspiro[4.5]decan-4-one

Drug info:

PubChemData

Smile

CN(C)CC1=NC(=CS1)CSCCN.Cl

DOS

IR

Vibrations