Geometry & MOs

Info

ID:	249451
PubChem CID:	103089516
Reduced:	OSN2C13H28 (1)
Stoich.:	ABC2D13E28 (1)
Weight, g/mol:	216.16602
ΔH_f, kcal/mol:	-67.46
Dipole, Da:	4.81
IP(EA), eV:	-8.38(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-N-methyl-N-(4-methylsulfanylbutyl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CSCCCCN1CCC(CC1)OCCCN

DOS

IR

Vibrations