Geometry & MOs

Info

ID:	249355
PubChem CID:	103088901
Reduced:	SN2C13H26 (1)
Stoich.:	AB2C13D26 (1)
Weight, g/mol:	244.19732
ΔH_f, kcal/mol:	22.42
Dipole, Da:	2.47
IP(EA), eV:	-8.35(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-cycloheptyl-5-methylsulfanylpentane-1,2-diamine

Drug info:

PubChemData

Smile

CSCCCC(CN)N(CC1CC1)C2CC2

DOS

IR

Vibrations