Geometry & MOs

Info

ID:	57366
PubChem CID:	22395755
Reduced:	OH8C10 (1)
Stoich.:	AB8C10 (1)
Weight, g/mol:	304.106791
ΔH_f, kcal/mol:	151.26
Dipole, Da:	1.44
IP(EA), eV:	-8.6(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[[2-(aminomethyl)phenyl]methyldisulfanyl]methyl]phenyl]methanamine

Drug info:

PubChemData

Smile

C1C=CC2=C1C3=CC(=C2C3)O

DOS

IR

Vibrations