Geometry & MOs

Info

ID:	249163
PubChem CID:	103087315
Reduced:	NOSC11H25 (1)
Stoich.:	ABCD11E25 (1)
Weight, g/mol:	253.150036
ΔH_f, kcal/mol:	-76.57
Dipole, Da:	1.67
IP(EA), eV:	-8.52(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylsulfanylbutyl)-4-propan-2-yloxyaniline

Drug info:

PubChemData

Smile

CC(C)OCCCNCCCCSC

DOS

IR

Vibrations