Geometry & MOs

Info

ID:	249178
PubChem CID:	103087455
Reduced:	NSO2C15H23 (1)
Stoich.:	ABC2D15E23 (1)
Weight, g/mol:	237.155121
ΔH_f, kcal/mol:	-93.31
Dipole, Da:	5.97
IP(EA), eV:	-8.52(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylsulfanylbutyl)-2-propylaniline

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=CC=C(C=C1)NCCCCSC

DOS

IR

Vibrations