Geometry & MOs

Info

ID:	249319
PubChem CID:	103088596
Reduced:	SN2C18H30 (1)
Stoich.:	AB2C18D30 (1)
Weight, g/mol:	204.16602
ΔH_f, kcal/mol:	-4.92
Dipole, Da:	3.17
IP(EA), eV:	-8.57(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-methyl-5-methylsulfanyl-2-N-propylpentane-1,2-diamine

Drug info:

PubChemData

Smile

CSCCCC(CN)N1CCC(CC1)CC2=CC=CC=C2

DOS

IR

Vibrations