Geometry & MOs

Info

ID:	204098
PubChem CID:	79911237
Reduced:	NOSC16H31 (1)
Stoich.:	ABCD16E31 (1)
Weight, g/mol:	287.1919
ΔH_f, kcal/mol:	-88.16
Dipole, Da:	1.39
IP(EA), eV:	-8.12(1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-methoxy-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)propan-1-amine

Drug info:

PubChemData

Smile

CCNC(CSCC)C1CCOC2(C1)CCCCC2

DOS

IR

Vibrations