Geometry & MOs

Info

ID:	204055
PubChem CID:	79905351
Reduced:	OSN4C13H20 (1)
Stoich.:	ABC4D13E20 (1)
Weight, g/mol:	301.182398
ΔH_f, kcal/mol:	-36.12
Dipole, Da:	4.45
IP(EA), eV:	-8.77(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[ethyl(1-oxa-9-thiaspiro[5.5]undecan-4-yl)amino]-N'-hydroxypropanimidamide

Drug info:

PubChemData

Smile

C1CCC2(C1)CC(CCO2)SC3=NC(=CC(=N3)N)N

DOS

IR

Vibrations