Geometry & MOs

Info

ID:	249303
PubChem CID:	103088438
Reduced:	NOSC11H23 (1)
Stoich.:	ABCD11E23 (1)
Weight, g/mol:	205.150036
ΔH_f, kcal/mol:	-72.35
Dipole, Da:	3.07
IP(EA), eV:	-8.54(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylsulfanylbutylamino)pentan-3-ol

Drug info:

PubChemData

Smile

CC1(CCOCC1)NCCCCSC

DOS

IR

Vibrations