Geometry & MOs

Info

ID:	126057
PubChem CID:	50949898
Reduced:	O3N5C18H21 (1)
Stoich.:	A3B5C18D21 (1)
Weight, g/mol:	351.125277
ΔH_f, kcal/mol:	8.16
Dipole, Da:	3.75
IP(EA), eV:	-9.1(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)sulfonyl]-3H-1,3-benzoxazol-2-one

Drug info:

PubChemData

Smile

CN(CC1=NNC2=C1CCC2)C(=O)CCCC3=NC(=NO3)C4=CC=CO4

DOS

IR

Vibrations