Geometry & MOs

Info

ID:	249248
PubChem CID:	103088050
Reduced:	NSC12H25 (1)
Stoich.:	ABC12D25 (1)
Weight, g/mol:	243.202071
ΔH_f, kcal/mol:	-14.49
Dipole, Da:	2.0
IP(EA), eV:	-8.51(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylcyclohexyl)ethyl]-4-methylsulfanylbutan-1-amine

Drug info:

PubChemData

Smile

CCC(CC1CC1)NCCCCSC

DOS

IR

Vibrations