Geometry & MOs

Info

ID:	204005
PubChem CID:	79899614
Reduced:	NSO2C17H31 (1)
Stoich.:	ABC2D17E31 (1)
Weight, g/mol:	307.1606
ΔH_f, kcal/mol:	-134.42
Dipole, Da:	5.86
IP(EA), eV:	-8.29(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-oxa-9-thiaspiro[5.5]undecan-4-ylamino)-2-phenylethanol

Drug info:

PubChemData

Smile

CC1CCC(CC1)(CO)NC2CCOC3(C2)CCSCC3

DOS

IR

Vibrations