Geometry & MOs

Info

ID:	256818
PubChem CID:	103141590
Reduced:	ON2C18H32 (1)
Stoich.:	AB2C18D32 (1)
Weight, g/mol:	295.114319
ΔH_f, kcal/mol:	-59.58
Dipole, Da:	2.13
IP(EA), eV:	-8.43(2.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[isoquinolin-8-yl-(2-methylsulfanylphenyl)methyl]hydrazine

Drug info:

PubChemData

Smile

CC1CCC(O1)CN2CC(NCC23CCCCC3)C4CC4

DOS

IR

Vibrations