Geometry & MOs

Info

ID:	439498
PubChem CID:	135229272
Reduced:	N2C3H7 (2)
Stoich.:	A2B3C7 (2)
Weight, g/mol:	608.423164
ΔH_f, kcal/mol:	24.27
Dipole, Da:	2.03
IP(EA), eV:	-9.03(1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[2-[bis(2-ethylsulfanylethyl)amino]ethyl]-2-methyl-2lambda4-thiatricyclo[4.3.1.03,10]decan-2-yl]-N,N-dimethyl-2,3,3a,4,5,5a,6,7,8,9,9a,9b-dodecahydro-1H-cyclopenta[a]naphthalen-5-amine

Drug info:

PubChemData

Smile

C1CN2CN1CN(C2)CN

DOS

IR

Vibrations