Geometry & MOs

Info

ID:	204014
PubChem CID:	79901077
Reduced:	OSN2C17H24 (1)
Stoich.:	ABC2D17E24 (1)
Weight, g/mol:	330.179956
ΔH_f, kcal/mol:	-12.14
Dipole, Da:	2.63
IP(EA), eV:	-8.7(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-methylpropyl(1-oxa-9-thiaspiro[5.5]undecan-4-yl)amino]propanethioamide

Drug info:

PubChemData

Smile

C1CC2(C1)CC(CCO2)N(CCC(=S)N)C3=CC=CC=C3

DOS

IR

Vibrations