Geometry & MOs

Info

ID:	204072
PubChem CID:	79908768
Reduced:	NSO2C14H27 (1)
Stoich.:	ABC2D14E27 (1)
Weight, g/mol:	269.235479
ΔH_f, kcal/mol:	-124.49
Dipole, Da:	7.2
IP(EA), eV:	-8.14(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-oxaspiro[4.5]decan-9-yl)-4-(propan-2-ylamino)butan-2-ol

Drug info:

PubChemData

Smile

CC(CCNC)(C1CCOC2(C1)CCSCC2)O

DOS

IR

Vibrations