Geometry & MOs

Info

ID:	358948
PubChem CID:	127296839
Reduced:	SO2N3C18H23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	317.173942
ΔH_f, kcal/mol:	-66.78
Dipole, Da:	3.56
IP(EA), eV:	-8.91(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)-1,3-diazaspiro[4.6]undecane-2,4-dione

Drug info:

PubChemData

Smile

C1CCC2=C(CC1)SC3=C2C(=O)N(C=N3)CC(=O)NCC4CCC4

DOS

IR

Vibrations