Geometry & MOs

Info

ID:	252171
PubChem CID:	103109590
Reduced:	SN2C9H22 (1)
Stoich.:	AB2C9D22 (1)
Weight, g/mol:	252.16602
ΔH_f, kcal/mol:	-16.6
Dipole, Da:	1.85
IP(EA), eV:	-8.52(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-ethyl-1-N-methyl-2-N-(2-phenylsulfanylethyl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(C)CC(C)NCCSC

DOS

IR

Vibrations