Geometry & MOs

Info

ID:	199224
PubChem CID:	79219753
Reduced:	ClOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	322.119858
ΔH_f, kcal/mol:	-54.14
Dipole, Da:	0.96
IP(EA), eV:	-8.74(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl(methyl)amino]propanoate

Drug info:

PubChemData

Smile

CCCC(C)(CC1COC2=CC=CC=C12)CCl

DOS

IR

Vibrations