Geometry & MOs

Info

ID:	249377
PubChem CID:	103089078
Reduced:	NSC6H13 (2)
Stoich.:	ABC6D13 (2)
Weight, g/mol:	264.169391
ΔH_f, kcal/mol:	-31.66
Dipole, Da:	2.83
IP(EA), eV:	-8.47(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-methyl-5-methylsulfanyl-2-N-(4-methylsulfanylbutan-2-yl)pentane-1,2-diamine

Drug info:

PubChemData

Smile

CC1(CN(CCS1)C(CCCSC)CN)C

DOS

IR

Vibrations