Geometry & MOs

Info

ID:	249304
PubChem CID:	103088452
Reduced:	NOSC10H23 (1)
Stoich.:	ABCD10E23 (1)
Weight, g/mol:	221.127192
ΔH_f, kcal/mol:	-80.31
Dipole, Da:	3.31
IP(EA), eV:	-8.58(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylsulfanylpropan-2-yl)-4-methylsulfanylbutan-1-amine

Drug info:

PubChemData

Smile

CCC(CCNCCCCSC)O

DOS

IR

Vibrations